2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine

C17H29N3 — CID 60916986

IUPAC2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine
SMILESCCCC1CCC(N)C(N(C)CCc2ccccn2)C1
InChIInChI=1S/C17H29N3/c1-3-6-14-8-9-16(18)17(13-14)20(2)12-10-15-7-4-5-11-19-15/h4-5,7,11,14,16-17H,3,6,8-10,12-13,18H2,1-2H3
InChIKeyQFOIWFBSHWKWLA-UHFFFAOYSA-N
MW275.44 g/mol
LogP2.85
Rot. Bonds6

About 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine

2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine (PubChem CID 60916986) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine
PubChem CID60916986
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC Name2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine
SMILESCCCC1CCC(N)C(N(C)CCc2ccccn2)C1
InChIInChI=1S/C17H29N3/c1-3-6-14-8-9-16(18)17(13-14)20(2)12-10-15-7-4-5-11-19-15/h4-5,7,11,14,16-17H,3,6,8-10,12-13,18H2,1-2H3
InChIKeyQFOIWFBSHWKWLA-UHFFFAOYSA-N
XLogP2.85
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N-methyl-1-N-(2-pyridin-2-ylethyl)cyclopentane-1,2-diamine
CID 43211466
2-[methyl(2-pyridin-2-ylethyl)amino]cyclopropane-1-carboxylic acid
CID 117042811
N-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 21307320
2-N-[1-(2-fluorophenyl)ethyl]-2-N-methyl-4-propylcyclohexane-1,2-diamine
CID 62978796
4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]cyclopent-2-en-1-amine
CID 79207735
2-methyl-2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]cyclopentan-1-amine
CID 82768381
1-butyl-1-(2-pyridin-2-ylethyl)hydrazine
CID 89336624
N-ethyl-2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]cyclohexan-1-amine
CID 62614406
4-methyl-2-(2-pyridin-2-ylethyl)cyclohexan-1-ol
CID 79423318
3-N-methyl-3-N-(pyridin-2-ylmethyl)cyclopentane-1,3-diamine
CID 79469541
2,2-dimethyl-5-[[methyl(2-pyridin-2-ylethyl)amino]methyl]cyclopentan-1-ol
CID 79856114
N-propyl-N-(2-pyridin-2-ylethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 61232143

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine?
The IUPAC name of 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine (CID 60916986) is 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine.
What is the SMILES notation for 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine?
The canonical SMILES for 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine is CCCC1CCC(N)C(N(C)CCc2ccccn2)C1.
What is the InChIKey of 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine?
The InChIKey is QFOIWFBSHWKWLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-3-6-14-8-9-16(18)17(13-14)20(2)12-10-15-7-4-5-11-19-15/h4-5,7,11,14,16-17H,3,6,8-10,12-13,18H2,1-2H3.
What are the key properties of 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine?
2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine has a molecular weight of 275.44 g/mol, XLogP of 2.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-4-propyl-2-N-(2-pyridin-2-ylethyl)cyclohexane-1,2-diamine is sourced from PubChem (CID 60916986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).