3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide

C16H16N2O3 — CID 142649107

IUPAC3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NC2CC2c2ccccc2)c1O
InChIInChI=1S/C16H16N2O3/c1-21-13-7-8-17-14(15(13)19)16(20)18-12-9-11(12)10-5-3-2-4-6-10/h2-8,11-12,19H,9H2,1H3,(H,18,20)
InChIKeyPNOVWHKYRMAXTH-UHFFFAOYSA-N
MW284.31 g/mol
LogP2.08
Rot. Bonds4

About 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide

3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide (PubChem CID 142649107) has the molecular formula C16H16N2O3 and a molecular weight of 284.31 g/mol. Its IUPAC name is 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide
PubChem CID142649107
Molecular FormulaC16H16N2O3
Molecular Weight284.31 g/mol
Exact Mass284.12
IUPAC Name3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NC2CC2c2ccccc2)c1O
InChIInChI=1S/C16H16N2O3/c1-21-13-7-8-17-14(15(13)19)16(20)18-12-9-11(12)10-5-3-2-4-6-10/h2-8,11-12,19H,9H2,1H3,(H,18,20)
InChIKeyPNOVWHKYRMAXTH-UHFFFAOYSA-N
XLogP2.08
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclobutyl-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 21088893
N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 21088897
3-hydroxy-4-methoxy-N-(5-methyloxolan-3-yl)pyridine-2-carboxamide
CID 18681928
3-hydroxy-4-methoxy-N-(2-phenylethyl)pyridine-2-carboxamide
CID 21088902
3-hydroxy-4-methoxy-N-(1-oxo-3,4-dihydro-2H-naphthalen-2-yl)pyridine-2-carboxamide
CID 18681858
3-hydroxy-4-methoxy-N-pyridin-2-ylpyridine-2-carboxamide
CID 21088884
3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide
CID 142553714
N-(2-benzyl-2,6-dimethyloxan-4-yl)-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 18682229
3-hydroxy-N-[(3S,7R,8R,9S)-2-hydroxy-9-methyl-8-phenoxy-7-(2-phenoxyethyl)oxonan-3-yl]-4-methoxypyridine-2-carboxamide
CID 129059115
N-[(1S,2R)-2-phenylcyclopropyl]benzamide
CID 7350127
3-hydroxy-4-methoxy-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 11244594
3-amino-5-methyl-N-(2-phenylcyclopropyl)pyrazine-2-carboxamide
CID 10038673

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide?
The IUPAC name of 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide (CID 142649107) is 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide?
The canonical SMILES for 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide is COc1ccnc(C(=O)NC2CC2c2ccccc2)c1O.
What is the InChIKey of 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide?
The InChIKey is PNOVWHKYRMAXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-21-13-7-8-17-14(15(13)19)16(20)18-12-9-11(12)10-5-3-2-4-6-10/h2-8,11-12,19H,9H2,1H3,(H,18,20).
What are the key properties of 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide?
3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide has a molecular weight of 284.31 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-4-methoxy-N-(2-phenylcyclopropyl)pyridine-2-carboxamide is sourced from PubChem (CID 142649107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).