N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide

C13H18N2O3 — CID 21088897

IUPACN-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NC2CCCCC2)c1O
InChIInChI=1S/C13H18N2O3/c1-18-10-7-8-14-11(12(10)16)13(17)15-9-5-3-2-4-6-9/h7-9,16H,2-6H2,1H3,(H,15,17)
InChIKeyAOVCZBHUSBAWLE-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.86
Rot. Bonds3

About N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide

N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide (PubChem CID 21088897) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide
PubChem CID21088897
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC NameN-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NC2CCCCC2)c1O
InChIInChI=1S/C13H18N2O3/c1-18-10-7-8-14-11(12(10)16)13(17)15-9-5-3-2-4-6-9/h7-9,16H,2-6H2,1H3,(H,15,17)
InChIKeyAOVCZBHUSBAWLE-UHFFFAOYSA-N
XLogP1.86
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclobutyl-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 21088893
3-hydroxy-4-methoxy-N-(5-methyloxolan-3-yl)pyridine-2-carboxamide
CID 18681928
3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide
CID 142553714
3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide
CID 142649107
1-cyclohexylpropyl (2S)-2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]propanoate
CID 165176388
[4-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]-2,2,6,6-tetramethylcyclohexyl] 3-methylbutanoate
CID 18681983
3-hydroxy-4-methoxy-N-(1-oxo-3,4-dihydro-2H-naphthalen-2-yl)pyridine-2-carboxamide
CID 18681858
3-hydroxy-4-methoxy-N-[(2S)-3-oxobutan-2-yl]pyridine-2-carboxamide
CID 163574923
N-heptyl-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 21088900
N-cyclohexyl-2-methoxypyridine-4-carboxamide
CID 110848962
N-cyclohexyl-3-hydroxy-4-methoxybenzamide
CID 79600190
3-hydroxy-4-methoxy-N-(2-phenylethyl)pyridine-2-carboxamide
CID 21088902

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide?
The IUPAC name of N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide (CID 21088897) is N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide is COc1ccnc(C(=O)NC2CCCCC2)c1O.
What is the InChIKey of N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide?
The InChIKey is AOVCZBHUSBAWLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-18-10-7-8-14-11(12(10)16)13(17)15-9-5-3-2-4-6-9/h7-9,16H,2-6H2,1H3,(H,15,17).
What are the key properties of N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide?
N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide is sourced from PubChem (CID 21088897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).