5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide

C15H15ClN2O3 — CID 110860456

IUPAC5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide
SMILESCC(C)Oc1ccc(NC(=O)c2cc(Cl)c[nH]c2=O)cc1
InChIInChI=1S/C15H15ClN2O3/c1-9(2)21-12-5-3-11(4-6-12)18-15(20)13-7-10(16)8-17-14(13)19/h3-9H,1-2H3,(H,17,19)(H,18,20)
InChIKeyWOERPSBJHYRAHX-UHFFFAOYSA-N
MW306.75 g/mol
LogP3.07
Rot. Bonds4

About 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide

5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide (PubChem CID 110860456) has the molecular formula C15H15ClN2O3 and a molecular weight of 306.75 g/mol. Its IUPAC name is 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide
PubChem CID110860456
Molecular FormulaC15H15ClN2O3
Molecular Weight306.75 g/mol
Exact Mass306.08
IUPAC Name5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide
SMILESCC(C)Oc1ccc(NC(=O)c2cc(Cl)c[nH]c2=O)cc1
InChIInChI=1S/C15H15ClN2O3/c1-9(2)21-12-5-3-11(4-6-12)18-15(20)13-7-10(16)8-17-14(13)19/h3-9H,1-2H3,(H,17,19)(H,18,20)
InChIKeyWOERPSBJHYRAHX-UHFFFAOYSA-N
XLogP3.07
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-2-nitro-N-(4-propan-2-yloxyphenyl)benzamide
CID 19173715
5,6-dimethoxy-N-(4-propan-2-yloxyphenyl)-1H-indole-3-carboxamide
CID 113206992
3-bromo-2-chloro-N-(4-propan-2-yloxyphenyl)benzamide
CID 103988657
2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 110761096
2,5-dibromo-N-(4-propan-2-yloxyphenyl)benzamide
CID 114370108
6-chloro-N-(4-propan-2-yloxyphenyl)-1H-indole-2-carboxamide
CID 113207580
2-bromo-5-methoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 55749089
2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide
CID 62510532
N-(4-methoxyphenyl)-2-oxo-5-pyridin-4-yl-1H-pyridine-3-carboxamide
CID 58692594
1-(2,5-dichlorophenyl)-3-(4-propan-2-yloxyphenyl)urea
CID 108992164
5-amino-N-(4-propan-2-yloxyphenyl)-1H-pyrazole-4-carboxamide
CID 43337237
2-amino-4-fluoro-N-(4-propan-2-yloxyphenyl)benzamide
CID 63109637

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide (CID 110860456) is 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide is CC(C)Oc1ccc(NC(=O)c2cc(Cl)c[nH]c2=O)cc1.
What is the InChIKey of 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide?
The InChIKey is WOERPSBJHYRAHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O3/c1-9(2)21-12-5-3-11(4-6-12)18-15(20)13-7-10(16)8-17-14(13)19/h3-9H,1-2H3,(H,17,19)(H,18,20).
What are the key properties of 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide?
5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide has a molecular weight of 306.75 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-oxo-N-(4-propan-2-yloxyphenyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 110860456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).