N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide

C19H16N2O3 — CID 112988117

IUPACN-[4-(3-acetylanilino)phenyl]furan-2-carboxamide
SMILESCC(=O)c1cccc(Nc2ccc(NC(=O)c3ccco3)cc2)c1
InChIInChI=1S/C19H16N2O3/c1-13(22)14-4-2-5-17(12-14)20-15-7-9-16(10-8-15)21-19(23)18-6-3-11-24-18/h2-12,20H,1H3,(H,21,23)
InChIKeyQAIPUNPOHNHFIC-UHFFFAOYSA-N
MW320.35 g/mol
LogP4.48
Rot. Bonds5

About N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide

N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide (PubChem CID 112988117) has the molecular formula C19H16N2O3 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(3-acetylanilino)phenyl]furan-2-carboxamide
PubChem CID112988117
Molecular FormulaC19H16N2O3
Molecular Weight320.35 g/mol
Exact Mass320.12
IUPAC NameN-[4-(3-acetylanilino)phenyl]furan-2-carboxamide
SMILESCC(=O)c1cccc(Nc2ccc(NC(=O)c3ccco3)cc2)c1
InChIInChI=1S/C19H16N2O3/c1-13(22)14-4-2-5-17(12-14)20-15-7-9-16(10-8-15)21-19(23)18-6-3-11-24-18/h2-12,20H,1H3,(H,21,23)
InChIKeyQAIPUNPOHNHFIC-UHFFFAOYSA-N
XLogP4.48
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(4-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 51179863
N-[3-[(3-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 27244358
N-[4-(3-acetylanilino)phenyl]benzamide
CID 112988119
N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 52907935
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-[3-[(3-ethenylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 891471
N-[3-(N-benzamido-C-methylcarbonimidoyl)phenyl]furan-2-carboxamide
CID 4548216
N-[4-(methylamino)phenyl]furan-2-carboxamide
CID 63091259
N-[4-(3-acetylanilino)phenyl]-3,4-dimethylbenzamide
CID 112988131
N-[3-[(2-benzamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 55934006
methyl N-[1-[3-(furan-2-carbonylamino)phenyl]ethylideneamino]carbamate
CID 3713909
N-[6-(3-acetamidoanilino)-3-pyridinyl]furan-2-carboxamide
CID 113020477

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide (CID 112988117) is N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide is CC(=O)c1cccc(Nc2ccc(NC(=O)c3ccco3)cc2)c1.
What is the InChIKey of N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide?
The InChIKey is QAIPUNPOHNHFIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3/c1-13(22)14-4-2-5-17(12-14)20-15-7-9-16(10-8-15)21-19(23)18-6-3-11-24-18/h2-12,20H,1H3,(H,21,23).
What are the key properties of N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide?
N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide has a molecular weight of 320.35 g/mol, XLogP of 4.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide is sourced from PubChem (CID 112988117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).