5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide

C18H19ClN2O3 — CID 91641085

IUPAC5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide
SMILESO=C(NC1CCCC1)c1cc(=O)c(OCc2cccc(Cl)c2)c[nH]1
InChIInChI=1S/C18H19ClN2O3/c19-13-5-3-4-12(8-13)11-24-17-10-20-15(9-16(17)22)18(23)21-14-6-1-2-7-14/h3-5,8-10,14H,1-2,6-7,11H2,(H,20,22)(H,21,23)
InChIKeyVBLPEJAOJPEFTQ-UHFFFAOYSA-N
MW346.81 g/mol
LogP3.28
Rot. Bonds5

About 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide

5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide (PubChem CID 91641085) has the molecular formula C18H19ClN2O3 and a molecular weight of 346.81 g/mol. Its IUPAC name is 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide
PubChem CID91641085
Molecular FormulaC18H19ClN2O3
Molecular Weight346.81 g/mol
Exact Mass346.11
IUPAC Name5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide
SMILESO=C(NC1CCCC1)c1cc(=O)c(OCc2cccc(Cl)c2)c[nH]1
InChIInChI=1S/C18H19ClN2O3/c19-13-5-3-4-12(8-13)11-24-17-10-20-15(9-16(17)22)18(23)21-14-6-1-2-7-14/h3-5,8-10,14H,1-2,6-7,11H2,(H,20,22)(H,21,23)
InChIKeyVBLPEJAOJPEFTQ-UHFFFAOYSA-N
XLogP3.28
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.81
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(1S,2S,4S)-2-bicyclo[2.2.1]hept-5-enyl]methyl]-5-[(3-chlorophenyl)methoxy]-4-oxo-1H-pyridine-2-carboxamide
CID 99796767
4-[5-[(3-chlorophenyl)methoxy]-4-oxo-1H-pyridine-2-carbonyl]piperazin-2-one
CID 52903063
N-(1-benzylpiperidin-4-yl)-5-methoxy-4-oxo-1H-pyridine-2-carboxamide
CID 127254911
2-N-[2-(3-chlorophenyl)ethyl]-1-N-cycloheptylcyclopropane-1,2-dicarboxamide
CID 109139702
5-[(3-methylphenyl)methoxy]-4-oxo-1H-pyridine-2-carboxylic acid
CID 82017868
N-(4-fluorophenyl)-4-oxo-5-phenylmethoxy-1H-pyridine-2-carboxamide
CID 42442339
N-(3,4-difluorophenyl)-4-oxo-5-phenylmethoxy-1H-pyridine-2-carboxamide
CID 42442345
3-[2-(3-chlorophenyl)ethoxy]-N-cycloheptyl-4-(2-hydroxyethoxy)benzamide
CID 141308833
N-[2-(3-chlorophenyl)ethyl]-N'-cyclopentyloxamide
CID 108984045
3-[(3-chlorophenyl)methoxy]-N-pyrrolidin-3-ylbenzamide
CID 119449796
5-[2-(3-chlorophenyl)ethylamino]-N-cyclohexylpyridine-2-carboxamide
CID 109182977
(2S)-2-[(S)-(3-chlorophenyl)methylsulfinyl]-N-cyclopentylpropanamide
CID 95599447

Frequently Asked Questions

What is the IUPAC name of 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide (CID 91641085) is 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide is O=C(NC1CCCC1)c1cc(=O)c(OCc2cccc(Cl)c2)c[nH]1.
What is the InChIKey of 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide?
The InChIKey is VBLPEJAOJPEFTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O3/c19-13-5-3-4-12(8-13)11-24-17-10-20-15(9-16(17)22)18(23)21-14-6-1-2-7-14/h3-5,8-10,14H,1-2,6-7,11H2,(H,20,22)(H,21,23).
What are the key properties of 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide?
5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide has a molecular weight of 346.81 g/mol, XLogP of 3.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-chlorophenyl)methoxy]-N-cyclopentyl-4-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 91641085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).