N-cyclohexyl-2-methylpyridine-3-carboxamide

C13H18N2O — CID 78951017

IUPACN-cyclohexyl-2-methylpyridine-3-carboxamide
SMILESCc1ncccc1C(=O)NC1CCCCC1
InChIInChI=1S/C13H18N2O/c1-10-12(8-5-9-14-10)13(16)15-11-6-3-2-4-7-11/h5,8-9,11H,2-4,6-7H2,1H3,(H,15,16)
InChIKeySMICPVCGJDBARB-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.45
Rot. Bonds2

About N-cyclohexyl-2-methylpyridine-3-carboxamide

N-cyclohexyl-2-methylpyridine-3-carboxamide (PubChem CID 78951017) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is N-cyclohexyl-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-methylpyridine-3-carboxamide
PubChem CID78951017
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC NameN-cyclohexyl-2-methylpyridine-3-carboxamide
SMILESCc1ncccc1C(=O)NC1CCCCC1
InChIInChI=1S/C13H18N2O/c1-10-12(8-5-9-14-10)13(16)15-11-6-3-2-4-7-11/h5,8-9,11H,2-4,6-7H2,1H3,(H,15,16)
InChIKeySMICPVCGJDBARB-UHFFFAOYSA-N
XLogP2.45
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-methylpyridine-3-carboxamide
CID 78950976
N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 44761338
2-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridine-3-carboxamide
CID 10199216
N-cyclopentyl-3-hydroxy-2-methylbenzamide
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N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide
CID 81485625
N-(2-cyclopentyl-2-hydroxyethyl)-2-methylpyridine-3-carboxamide
CID 111425985
N-cyclopentyl-2-(diethylamino)pyridine-3-carboxamide
CID 5077246
N-[4-[(4-chlorophenyl)methylcarbamoylamino]cyclohexyl]-2-methylpyridine-3-carboxamide
CID 166834895
N-cycloheptyl-2-fluoro-3-methylbenzamide
CID 80719060
2-[3-(cyclohexylcarbamoyl)-2-methylphenyl]acetic acid
CID 121005204
N-cyclohexyl-2-methyl-6-phenylpyridine-3-carboxamide
CID 3410229
N-cycloheptyl-1-(2-methyl-3-pyridinyl)pyrrole-2-carboxamide
CID 53054922

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-methylpyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-2-methylpyridine-3-carboxamide (CID 78951017) is N-cyclohexyl-2-methylpyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-methylpyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-2-methylpyridine-3-carboxamide is Cc1ncccc1C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-methylpyridine-3-carboxamide?
The InChIKey is SMICPVCGJDBARB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-10-12(8-5-9-14-10)13(16)15-11-6-3-2-4-7-11/h5,8-9,11H,2-4,6-7H2,1H3,(H,15,16).
What are the key properties of N-cyclohexyl-2-methylpyridine-3-carboxamide?
N-cyclohexyl-2-methylpyridine-3-carboxamide has a molecular weight of 218.30 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 78951017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).