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Molecule
ID:48934
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₀H₁₉ClN₂O₂
Molecular Mass
234.72306
Exact Mass
234.11350554
Charge
0
InChI
InChI=1S/C10H18N2O2.ClH/c13-10(9-3-1-2-4-11-9)12-5-7-14-8-6-12;/h9,11H,1-8H2;1H
InChIKey
QTMPLCRQSUNTJY-UHFFFAOYSA-N
Canonic Smiles
O=C(N1CCOCC1)C1CCCCN1.Cl
Isomeric Smiles
C(=O)(N1CCOCC1)C1NCCCC1.Cl
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
-3.2406607
LogD (pH = 7.4)
-1.7294265
Log P
-0.23066367
Molar Refractivity
53.3554
Polarizability
21.132917
Polar Surface Area
41.57
Rotatable Bonds
1
Lipinski's Rule of Five
true
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Molecule Details
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Bioactivity
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Data Source
Commercial Catalog
Matrix Scientific
052423
Apollo Scientific
OR12325
Maybridge
MO01179
Enamine
EN300-66199
Academic Data
PubChem
2794699
Names and Identifiers
Synonyms
4-Morpholinyl(2-piperidinyl)methanone hydrochloride
Morpholino(piperidin-2-yl)methanone hydrochloride
morpholino(2-piperidinyl)methanone hydrochloride
4-(Piperidin-2-ylcarbonyl)morpholine hydrochloride 97%
4-[(piperidin-2-yl)carbonyl]morpholine hydrochloride
IUPAC name
4-(piperidine-2-carbonyl)morpholine hydrochloride
IUPAC Traditional name
4-(piperidine-2-carbonyl)morpholine hydrochloride
Registration numbers
CAS Number
690634-79-8
MDL Number
MFCD05865124
PubChem SID
162053697
PubChem CID
2794699
Properties
Safety Information
TSCA Listed
false
Source
MSDS Link
Download link
Source
Storage Warning
IRRITANT
Source
Irritant/Store under Argon
Source
Physical Property
Melting Point
291-293°C
Source
Hydrophobicity(logP)
0.517
Source
Product Information
Purity
97%
Source
95%
Source
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay