2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide

C15H15ClN2O3 — CID 106685876

IUPAC2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide
SMILESCCCNC(=O)c1cccc(NC(=O)c2ccoc2Cl)c1
InChIInChI=1S/C15H15ClN2O3/c1-2-7-17-14(19)10-4-3-5-11(9-10)18-15(20)12-6-8-21-13(12)16/h3-6,8-9H,2,7H2,1H3,(H,17,19)(H,18,20)
InChIKeyORSCNSOTZGRLDQ-UHFFFAOYSA-N
MW306.75 g/mol
LogP3.33
Rot. Bonds5

About 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide

2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide (PubChem CID 106685876) has the molecular formula C15H15ClN2O3 and a molecular weight of 306.75 g/mol. Its IUPAC name is 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide
PubChem CID106685876
Molecular FormulaC15H15ClN2O3
Molecular Weight306.75 g/mol
Exact Mass306.08
IUPAC Name2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide
SMILESCCCNC(=O)c1cccc(NC(=O)c2ccoc2Cl)c1
InChIInChI=1S/C15H15ClN2O3/c1-2-7-17-14(19)10-4-3-5-11(9-10)18-15(20)12-6-8-21-13(12)16/h3-6,8-9H,2,7H2,1H3,(H,17,19)(H,18,20)
InChIKeyORSCNSOTZGRLDQ-UHFFFAOYSA-N
XLogP3.33
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-propylfuran-3-carboxamide
CID 106685121
2-chloro-N-[3-(propanoylamino)phenyl]furan-3-carboxamide
CID 106686546
3,5-dimethyl-N-[3-(propylcarbamoyl)phenyl]-1,2-oxazole-4-carboxamide
CID 46474322
3-N-(3-acetamidophenyl)-1-N-propylbenzene-1,3-dicarboxamide
CID 109050420
N-[3-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide
CID 63048189
2-chloro-N-(3-methylsulfanylphenyl)furan-3-carboxamide
CID 106685166
3-(ethylamino)-N-propylbenzamide
CID 43676038
2-methoxy-N-[3-(propylcarbamoyl)phenyl]thiophene-3-carboxamide
CID 154844991
3-[(2-aminoacetyl)amino]-N-propylbenzamide;hydrochloride
CID 119283116
3-fluoro-4-methyl-N-[3-(propylcarbamoyl)phenyl]benzamide
CID 46465371
5-[(2-chlorofuran-3-carbonyl)amino]benzene-1,3-dicarboxylic acid
CID 106683355
3-acetamido-4-methyl-N-[3-(propylcarbamoyl)phenyl]benzamide
CID 86991520

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide?
The IUPAC name of 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide (CID 106685876) is 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide is CCCNC(=O)c1cccc(NC(=O)c2ccoc2Cl)c1.
What is the InChIKey of 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide?
The InChIKey is ORSCNSOTZGRLDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O3/c1-2-7-17-14(19)10-4-3-5-11(9-10)18-15(20)12-6-8-21-13(12)16/h3-6,8-9H,2,7H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide?
2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide has a molecular weight of 306.75 g/mol, XLogP of 3.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[3-(propylcarbamoyl)phenyl]furan-3-carboxamide is sourced from PubChem (CID 106685876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).