N-(2-chlorophenyl)-4-oxochromene-2-carboxamide

C16H10ClNO3 — CID 892812

IUPACN-(2-chlorophenyl)-4-oxochromene-2-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1cc(=O)c2ccccc2o1
InChIInChI=1S/C16H10ClNO3/c17-11-6-2-3-7-12(11)18-16(20)15-9-13(19)10-5-1-4-8-14(10)21-15/h1-9H,(H,18,20)
InChIKeyWIYUELGMNKDRGE-UHFFFAOYSA-N
MW299.71 g/mol
LogP3.70
Rot. Bonds2

About N-(2-chlorophenyl)-4-oxochromene-2-carboxamide

N-(2-chlorophenyl)-4-oxochromene-2-carboxamide (PubChem CID 892812) has the molecular formula C16H10ClNO3 and a molecular weight of 299.71 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-oxochromene-2-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-oxochromene-2-carboxamide
PubChem CID892812
Molecular FormulaC16H10ClNO3
Molecular Weight299.71 g/mol
Exact Mass299.03
IUPAC NameN-(2-chlorophenyl)-4-oxochromene-2-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1cc(=O)c2ccccc2o1
InChIInChI=1S/C16H10ClNO3/c17-11-6-2-3-7-12(11)18-16(20)15-9-13(19)10-5-1-4-8-14(10)21-15/h1-9H,(H,18,20)
InChIKeyWIYUELGMNKDRGE-UHFFFAOYSA-N
XLogP3.70
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.71
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-chloro-5-(trifluoromethyl)phenyl]-4-oxochromene-2-carboxamide
CID 17014479
N-[3-chloro-2-(2-methoxyethoxy)phenyl]-4-oxochromene-2-carboxamide
CID 47081673
N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-4-oxochromene-2-carboxamide
CID 4077487
N-(2-hydroxy-4-methylphenyl)-4-oxochromene-2-carboxamide
CID 2474419
N-(3,5-dimethylphenyl)-4-oxochromene-2-carboxamide
CID 3536636
N-(3-chloropyrazin-2-yl)-4-oxochromene-2-carboxamide
CID 102989525
N-(5-fluoro-2-methylphenyl)-4-oxochromene-2-carboxamide
CID 9097785
5-amino-N-(2-chlorophenyl)furan-2-carboxamide
CID 82344260
4-methyl-3-[(4-oxochromene-2-carbonyl)amino]benzoic acid
CID 3400786
5-bromo-N-(2-chlorophenyl)-1-benzofuran-2-carboxamide
CID 2988849
N-[4-(2-amino-2-oxoethyl)phenyl]-4-oxochromene-2-carboxamide
CID 31855114
N-(3-chloro-2-methylphenyl)-8-methyl-4-oxochromene-2-carboxamide
CID 19119023

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-oxochromene-2-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-4-oxochromene-2-carboxamide (CID 892812) is N-(2-chlorophenyl)-4-oxochromene-2-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-oxochromene-2-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-4-oxochromene-2-carboxamide is O=C(Nc1ccccc1Cl)c1cc(=O)c2ccccc2o1.
What is the InChIKey of N-(2-chlorophenyl)-4-oxochromene-2-carboxamide?
The InChIKey is WIYUELGMNKDRGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClNO3/c17-11-6-2-3-7-12(11)18-16(20)15-9-13(19)10-5-1-4-8-14(10)21-15/h1-9H,(H,18,20).
What are the key properties of N-(2-chlorophenyl)-4-oxochromene-2-carboxamide?
N-(2-chlorophenyl)-4-oxochromene-2-carboxamide has a molecular weight of 299.71 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-oxochromene-2-carboxamide is sourced from PubChem (CID 892812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).