5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide

C19H16ClNO2 — CID 5262420

IUPAC5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide
SMILESCC(NC(=O)c1ccc(-c2ccccc2Cl)o1)c1ccccc1
InChIInChI=1S/C19H16ClNO2/c1-13(14-7-3-2-4-8-14)21-19(22)18-12-11-17(23-18)15-9-5-6-10-16(15)20/h2-13H,1H3,(H,21,22)
InChIKeyVYSPJHSZLCKXGZ-UHFFFAOYSA-N
MW325.80 g/mol
LogP5.09
Rot. Bonds4

About 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide

5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide (PubChem CID 5262420) has the molecular formula C19H16ClNO2 and a molecular weight of 325.80 g/mol. Its IUPAC name is 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide
PubChem CID5262420
Molecular FormulaC19H16ClNO2
Molecular Weight325.80 g/mol
Exact Mass325.09
IUPAC Name5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide
SMILESCC(NC(=O)c1ccc(-c2ccccc2Cl)o1)c1ccccc1
InChIInChI=1S/C19H16ClNO2/c1-13(14-7-3-2-4-8-14)21-19(22)18-12-11-17(23-18)15-9-5-6-10-16(15)20/h2-13H,1H3,(H,21,22)
InChIKeyVYSPJHSZLCKXGZ-UHFFFAOYSA-N
XLogP5.09
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.80
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2,4-dichlorophenyl)-N-[(1R)-1-phenylethyl]furan-2-carboxamide
CID 1292402
5-(2-fluorophenyl)-N-[(1R)-1-phenylethyl]furan-2-carboxamide
CID 51427238
(2R)-2-[[5-(2-chlorophenyl)furan-2-carbonyl]amino]-3-methylbutanoic acid
CID 119368356
5-(2-chlorophenyl)-N-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]furan-2-carboxamide
CID 97137892
5-(2-chlorophenyl)-N-(5-methylhexan-2-yl)furan-2-carboxamide
CID 16560702
5-(2-chlorophenyl)-N-(1-methoxypropan-2-yl)furan-2-carboxamide
CID 18161050
5-methyl-N-[(1S)-1-phenylethyl]furan-2-carboxamide
CID 844051
2-[5-(2-chlorophenyl)furan-2-yl]-N-(1-phenylethyl)quinoline-4-carboxamide
CID 18871547
5-(2-chlorophenyl)-N-ethylfuran-2-carboxamide
CID 51188744
5-(2-chlorophenyl)furan-2-carboxylic acid
CID 784625
5-amino-N-(1-phenylethyl)furan-2-carboxamide
CID 82344125
(2R)-2-amino-3-[[5-(2-chlorophenyl)furan-2-carbonyl]amino]propanoic acid
CID 166627868

Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide?
The IUPAC name of 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide (CID 5262420) is 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide.
What is the SMILES notation for 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide?
The canonical SMILES for 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide is CC(NC(=O)c1ccc(-c2ccccc2Cl)o1)c1ccccc1.
What is the InChIKey of 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide?
The InChIKey is VYSPJHSZLCKXGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClNO2/c1-13(14-7-3-2-4-8-14)21-19(22)18-12-11-17(23-18)15-9-5-6-10-16(15)20/h2-13H,1H3,(H,21,22).
What are the key properties of 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide?
5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide has a molecular weight of 325.80 g/mol, XLogP of 5.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide is sourced from PubChem (CID 5262420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).