Molecule

ID:33042

General Information
Structure
MolImage
Molecular Formula
C₅H₁₄N₂
Molecular Mass
102.17806
Exact Mass
102.11569846
Charge
0
InChI
InChI=1S/C5H14N2/c1-5(4-6)7(2)3/h5H,4,6H2,1-3H3
InChIKey
WNLWBCIUNCAMPH-UHFFFAOYSA-N
Canonic Smiles
NCC(N(C)C)C
Isomeric Smiles
N(C(CN)C)(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-4.97546
LogD (pH = 7.4)
-2.660345
Log P
-0.19023933
Molar Refractivity
32.3567
Polarizability
13.012255
Polar Surface Area
29.26
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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