2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine

C17H29N3 — CID 79853439

IUPAC2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine
SMILESCN(CCc1ccncc1)CC1CCCC(C)(C)C1N
InChIInChI=1S/C17H29N3/c1-17(2)9-4-5-15(16(17)18)13-20(3)12-8-14-6-10-19-11-7-14/h6-7,10-11,15-16H,4-5,8-9,12-13,18H2,1-3H3
InChIKeyHODXLNAOUHNISZ-UHFFFAOYSA-N
MW275.44 g/mol
LogP2.71
Rot. Bonds5

About 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine

2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine (PubChem CID 79853439) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine
PubChem CID79853439
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC Name2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine
SMILESCN(CCc1ccncc1)CC1CCCC(C)(C)C1N
InChIInChI=1S/C17H29N3/c1-17(2)9-4-5-15(16(17)18)13-20(3)12-8-14-6-10-19-11-7-14/h6-7,10-11,15-16H,4-5,8-9,12-13,18H2,1-3H3
InChIKeyHODXLNAOUHNISZ-UHFFFAOYSA-N
XLogP2.71
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine 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

2,2-dimethyl-5-[[methyl(2-phenylethyl)amino]methyl]cyclopentan-1-amine
CID 79855111
2-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-ol
CID 62609026
6-[[ethyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79852215
1-N-methyl-1-N-(2-pyridin-4-ylethyl)cyclopentane-1,2-diamine
CID 60912856
6-[[cyclobutylmethyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79849427
1-N,2-N,3,3-tetramethyl-1-N-(2-pyridin-4-ylethyl)cyclohexane-1,2-diamine
CID 79828998
2,2-dimethyl-5-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclopentan-1-one
CID 79865573
N-ethyl-2,2-dimethyl-6-[[methyl(pyridin-4-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 79842615
2-[[methyl(2-phenylethyl)amino]methyl]cyclopentan-1-amine
CID 65487102
2-[[methyl(pyridin-4-ylmethyl)amino]methyl]cyclopentan-1-amine
CID 62615408
N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]-2-pyridin-4-ylethanamine
CID 55229589
6-[[cyclohexyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79852212

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine (CID 79853439) is 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine is CN(CCc1ccncc1)CC1CCCC(C)(C)C1N.
What is the InChIKey of 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is HODXLNAOUHNISZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-17(2)9-4-5-15(16(17)18)13-20(3)12-8-14-6-10-19-11-7-14/h6-7,10-11,15-16H,4-5,8-9,12-13,18H2,1-3H3.
What are the key properties of 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine?
2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 275.44 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-[[methyl(2-pyridin-4-ylethyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 79853439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).