5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide

C13H12ClNO3 — CID 54963654

IUPAC5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide
SMILESCC(O)c1ccccc1NC(=O)c1ccc(Cl)o1
InChIInChI=1S/C13H12ClNO3/c1-8(16)9-4-2-3-5-10(9)15-13(17)11-6-7-12(14)18-11/h2-8,16H,1H3,(H,15,17)
InChIKeyDJRCTXWBRIDOBT-UHFFFAOYSA-N
MW265.70 g/mol
LogP3.24
Rot. Bonds3

About 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide

5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide (PubChem CID 54963654) has the molecular formula C13H12ClNO3 and a molecular weight of 265.70 g/mol. Its IUPAC name is 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide
PubChem CID54963654
Molecular FormulaC13H12ClNO3
Molecular Weight265.70 g/mol
Exact Mass265.05
IUPAC Name5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide
SMILESCC(O)c1ccccc1NC(=O)c1ccc(Cl)o1
InChIInChI=1S/C13H12ClNO3/c1-8(16)9-4-2-3-5-10(9)15-13(17)11-6-7-12(14)18-11/h2-8,16H,1H3,(H,15,17)
InChIKeyDJRCTXWBRIDOBT-UHFFFAOYSA-N
XLogP3.24
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-N-[2-(1-hydroxyethyl)phenyl]benzamide
CID 43508470
2,4-dichloro-N-[2-(1-hydroxyethyl)phenyl]benzamide
CID 43508509
5-(3,4-dichlorophenyl)-N-(2-propan-2-ylphenyl)furan-2-carboxamide
CID 23880214
N-[2-(1-chloroethyl)phenyl]-5-nitrofuran-2-carboxamide
CID 114304944
N-[2-(1-hydroxyethyl)phenyl]-2,2-dimethylbutanamide
CID 55103349
N-[2-(1-hydroxyethyl)phenyl]-4-phenoxybenzamide
CID 110885288
2-amino-4-bromo-N-[2-(1-hydroxyethyl)phenyl]benzamide
CID 79721735
5-(1-chloroethyl)-N-(2-hydroxyphenyl)furan-2-carboxamide
CID 82110591
3-chloro-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide
CID 62727616
5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide
CID 113290206
5-chloro-N-(2-chloropropyl)furan-2-carboxamide
CID 106689974
2-amino-2-ethyl-N-[2-(1-hydroxyethyl)phenyl]butanamide
CID 79813414

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide?
The IUPAC name of 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide (CID 54963654) is 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide is CC(O)c1ccccc1NC(=O)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide?
The InChIKey is DJRCTXWBRIDOBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO3/c1-8(16)9-4-2-3-5-10(9)15-13(17)11-6-7-12(14)18-11/h2-8,16H,1H3,(H,15,17).
What are the key properties of 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide?
5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide has a molecular weight of 265.70 g/mol, XLogP of 3.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 54963654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).