5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide

C14H13ClN2O3 — CID 110699924

IUPAC5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2C)o1
InChIInChI=1S/C14H13ClN2O3/c1-8-7-10(15)3-4-11(8)17-14(19)12-5-6-13(20-12)16-9(2)18/h3-7H,1-2H3,(H,16,18)(H,17,19)
InChIKeyPTRHTVJRJRWWEY-UHFFFAOYSA-N
MW292.72 g/mol
LogP3.45
Rot. Bonds3

About 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide

5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide (PubChem CID 110699924) has the molecular formula C14H13ClN2O3 and a molecular weight of 292.72 g/mol. Its IUPAC name is 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide
PubChem CID110699924
Molecular FormulaC14H13ClN2O3
Molecular Weight292.72 g/mol
Exact Mass292.06
IUPAC Name5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2C)o1
InChIInChI=1S/C14H13ClN2O3/c1-8-7-10(15)3-4-11(8)17-14(19)12-5-6-13(20-12)16-9(2)18/h3-7H,1-2H3,(H,16,18)(H,17,19)
InChIKeyPTRHTVJRJRWWEY-UHFFFAOYSA-N
XLogP3.45
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.72
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(4-chloro-2-methylphenyl)-1-benzofuran-2-carboxamide
CID 9138973
5-acetamido-N-(3,4-dichlorophenyl)furan-2-carboxamide
CID 110699992
5-acetamido-N-(4-chloro-2,5-dimethoxyphenyl)furan-2-carboxamide
CID 110699998
N-(4-chloro-2-methylphenyl)-2,4,5-trimethylbenzamide
CID 100708233
5-acetamido-N-(2-methoxy-5-methylphenyl)furan-2-carboxamide
CID 110699937
5-(3-chlorophenyl)-N-(2,4-dimethylphenyl)furan-2-carboxamide
CID 880542
5-acetamido-N-(2,6-difluorophenyl)furan-2-carboxamide
CID 110700006
N-(5-chloro-2-methylphenyl)-5-(4-chlorophenyl)furan-2-carboxamide
CID 4873369
N-(4-hydroxy-2-methylphenyl)-5-(methylsulfamoyl)furan-2-carboxamide
CID 84577321
N-(4-chloro-2-methylphenyl)-2,2-difluoroacetamide
CID 103605147
3,5-diamino-N-(4-chloro-2-methylphenyl)benzamide
CID 61093328
N-(4-bromo-2-methylphenyl)-5-chloro-1-benzofuran-2-carboxamide
CID 9159182

Frequently Asked Questions

What is the IUPAC name of 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide?
The IUPAC name of 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide (CID 110699924) is 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide is CC(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2C)o1.
What is the InChIKey of 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide?
The InChIKey is PTRHTVJRJRWWEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O3/c1-8-7-10(15)3-4-11(8)17-14(19)12-5-6-13(20-12)16-9(2)18/h3-7H,1-2H3,(H,16,18)(H,17,19).
What are the key properties of 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide?
5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide has a molecular weight of 292.72 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetamido-N-(4-chloro-2-methylphenyl)furan-2-carboxamide is sourced from PubChem (CID 110699924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).