2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile

C16H24N4 — CID 114770120

IUPAC2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile
SMILESCCN(c1cc(C#N)cc(C)n1)C1CCCCC1CN
InChIInChI=1S/C16H24N4/c1-3-20(15-7-5-4-6-14(15)11-18)16-9-13(10-17)8-12(2)19-16/h8-9,14-15H,3-7,11,18H2,1-2H3
InChIKeySRYOJODLQLPOEP-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.61
Rot. Bonds4

About 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile

2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile (PubChem CID 114770120) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile.

Molecular Properties

Compound Name2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile
PubChem CID114770120
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC Name2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile
SMILESCCN(c1cc(C#N)cc(C)n1)C1CCCCC1CN
InChIInChI=1S/C16H24N4/c1-3-20(15-7-5-4-6-14(15)11-18)16-9-13(10-17)8-12(2)19-16/h8-9,14-15H,3-7,11,18H2,1-2H3
InChIKeySRYOJODLQLPOEP-UHFFFAOYSA-N
XLogP2.61
TPSA65.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile 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-(aminomethyl)cyclopentyl]-ethylamino]-6-methylpyridine-4-carbonitrile
CID 114770116
2-[[2-(aminomethyl)cyclopentyl]-ethylamino]-6-methylpyrimidine-4-carbonitrile
CID 107552593
2-[(4-aminocyclohexyl)-ethylamino]-6-methylpyridine-4-carbonitrile
CID 114770148
2-[cyclopentyl(2-methylpropyl)amino]-6-methylpyridine-4-carbonitrile
CID 114766447
2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-5-bromobenzonitrile
CID 114894077
2-[cyclopropyl(prop-2-enyl)amino]-6-methylpyridine-4-carbonitrile
CID 114766517
3-[[2-(aminomethyl)cyclopentyl]-ethylamino]-5,6-dimethylpyridazine-4-carbonitrile
CID 80514923
N-[2-(aminomethyl)cyclohexyl]-N-ethyl-6-methylsulfanylpyrimidin-4-amine
CID 106973266
2-[ethyl(piperidin-4-ylmethyl)amino]-6-methylpyridine-4-carbonitrile
CID 114770166
N-[2-(aminomethyl)cyclohexyl]-N-ethyl-4,5-dihydro-1H-imidazol-2-amine
CID 114400565
4-(aminomethyl)-N-cyclohexyl-N-ethyl-6-methylpyridin-2-amine
CID 113379299
2-[[2-(aminomethyl)cyclopentyl]-ethylamino]-4-methoxybenzonitrile
CID 81304710

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile?
The IUPAC name of 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile (CID 114770120) is 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile.
What is the SMILES notation for 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile?
The canonical SMILES for 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile is CCN(c1cc(C#N)cc(C)n1)C1CCCCC1CN.
What is the InChIKey of 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile?
The InChIKey is SRYOJODLQLPOEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-3-20(15-7-5-4-6-14(15)11-18)16-9-13(10-17)8-12(2)19-16/h8-9,14-15H,3-7,11,18H2,1-2H3.
What are the key properties of 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile?
2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile has a molecular weight of 272.40 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(aminomethyl)cyclohexyl]-ethylamino]-6-methylpyridine-4-carbonitrile is sourced from PubChem (CID 114770120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).