1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide

C15H19N3O — CID 61482749

IUPAC1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
SMILESCN(Cc1ccccn1)C(=O)C1(C#N)CCCCC1
InChIInChI=1S/C15H19N3O/c1-18(11-13-7-3-6-10-17-13)14(19)15(12-16)8-4-2-5-9-15/h3,6-7,10H,2,4-5,8-9,11H2,1H3
InChIKeyWPQPFKWFMSUYGD-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.51
Rot. Bonds3

About 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide

1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide (PubChem CID 61482749) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
PubChem CID61482749
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
SMILESCN(Cc1ccccn1)C(=O)C1(C#N)CCCCC1
InChIInChI=1S/C15H19N3O/c1-18(11-13-7-3-6-10-17-13)14(19)15(12-16)8-4-2-5-9-15/h3,6-7,10H,2,4-5,8-9,11H2,1H3
InChIKeyWPQPFKWFMSUYGD-UHFFFAOYSA-N
XLogP2.51
TPSA56.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide 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-cyano-N-methyl-N-(pyridin-4-ylmethyl)cyclopentane-1-carboxamide
CID 47413974
1-amino-N-methyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 65466995
1-cyano-N-methyl-N-(pyridin-4-ylmethyl)cyclobutane-1-carboxamide
CID 78994564
1-(N'-hydroxycarbamimidoyl)-N-methyl-N-(pyridin-2-ylmethyl)cyclopentane-1-carboxamide
CID 76920403
1-carbamothioyl-N-methyl-N-(pyridin-2-ylmethyl)cyclobutane-1-carboxamide
CID 80589192
N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 63130322
N-[(4-bromophenyl)methyl]-1-cyano-N-methylcyclopentane-1-carboxamide
CID 60678400
1-[(Z)-N'-hydroxycarbamimidoyl]-N-methyl-N-(pyridin-2-ylmethyl)cyclobutane-1-carboxamide
CID 80597062
1-cyano-N-methyl-N-propylcycloheptane-1-carboxamide
CID 55207638
1-cyano-N-methyl-N-(1H-pyrrol-2-ylmethyl)cyclobutane-1-carboxamide
CID 115183346
N-methyl-N-(pyridin-2-ylmethyl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 63709306
1-cyano-N-[(4-fluorophenyl)methyl]-N-methylcyclobutane-1-carboxamide
CID 78994705

Frequently Asked Questions

What is the IUPAC name of 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide (CID 61482749) is 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide is CN(Cc1ccccn1)C(=O)C1(C#N)CCCCC1.
What is the InChIKey of 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide?
The InChIKey is WPQPFKWFMSUYGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-18(11-13-7-3-6-10-17-13)14(19)15(12-16)8-4-2-5-9-15/h3,6-7,10H,2,4-5,8-9,11H2,1H3.
What are the key properties of 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide?
1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide has a molecular weight of 257.34 g/mol, XLogP of 2.51, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyano-N-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 61482749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).