N-(4-anilinophenyl)-3-(furan-2-yl)benzamide

C23H18N2O2 — CID 168528867

IUPACN-(4-anilinophenyl)-3-(furan-2-yl)benzamide
SMILESO=C(Nc1ccc(Nc2ccccc2)cc1)c1cccc(-c2ccco2)c1
InChIInChI=1S/C23H18N2O2/c26-23(18-7-4-6-17(16-18)22-10-5-15-27-22)25-21-13-11-20(12-14-21)24-19-8-2-1-3-9-19/h1-16,24H,(H,25,26)
InChIKeyNREWHXPVSUMEFY-UHFFFAOYSA-N
MW354.41 g/mol
LogP5.94
Rot. Bonds5

About N-(4-anilinophenyl)-3-(furan-2-yl)benzamide

N-(4-anilinophenyl)-3-(furan-2-yl)benzamide (PubChem CID 168528867) has the molecular formula C23H18N2O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is N-(4-anilinophenyl)-3-(furan-2-yl)benzamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)-3-(furan-2-yl)benzamide
PubChem CID168528867
Molecular FormulaC23H18N2O2
Molecular Weight354.41 g/mol
Exact Mass354.14
IUPAC NameN-(4-anilinophenyl)-3-(furan-2-yl)benzamide
SMILESO=C(Nc1ccc(Nc2ccccc2)cc1)c1cccc(-c2ccco2)c1
InChIInChI=1S/C23H18N2O2/c26-23(18-7-4-6-17(16-18)22-10-5-15-27-22)25-21-13-11-20(12-14-21)24-19-8-2-1-3-9-19/h1-16,24H,(H,25,26)
InChIKeyNREWHXPVSUMEFY-UHFFFAOYSA-N
XLogP5.94
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.41
LogP ≤ 55.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(furan-2-yl)-1-N,3-N-diphenylbenzene-1,3-dicarboxamide
CID 168527471
N-(4-anilinophenyl)-4-benzamidobenzamide
CID 52560314
N-(4-anilinophenyl)-4-phenylbenzamide
CID 3363408
N-cyclopropyl-3-(furan-2-yl)benzamide
CID 168525147
N-(4-acetamidophenyl)-3-phenylbenzamide
CID 117092873
3-(furan-2-yl)benzoate
CID 7023055
3-(furan-2-yl)-N-methyl-N-phenylbenzamide
CID 168526169
N-(5-chloro-2-methylphenyl)-3-(furan-2-yl)benzamide
CID 168527887
N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide
CID 168526932
3-(furan-2-yl)-N-(2,2,2-trifluoroethyl)benzamide
CID 168526489
N-[4-(3-acetylanilino)phenyl]benzamide
CID 112988119
N-[4-(3-fluoroanilino)phenyl]benzamide
CID 112988934

Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)-3-(furan-2-yl)benzamide?
The IUPAC name of N-(4-anilinophenyl)-3-(furan-2-yl)benzamide (CID 168528867) is N-(4-anilinophenyl)-3-(furan-2-yl)benzamide.
What is the SMILES notation for N-(4-anilinophenyl)-3-(furan-2-yl)benzamide?
The canonical SMILES for N-(4-anilinophenyl)-3-(furan-2-yl)benzamide is O=C(Nc1ccc(Nc2ccccc2)cc1)c1cccc(-c2ccco2)c1.
What is the InChIKey of N-(4-anilinophenyl)-3-(furan-2-yl)benzamide?
The InChIKey is NREWHXPVSUMEFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O2/c26-23(18-7-4-6-17(16-18)22-10-5-15-27-22)25-21-13-11-20(12-14-21)24-19-8-2-1-3-9-19/h1-16,24H,(H,25,26).
What are the key properties of N-(4-anilinophenyl)-3-(furan-2-yl)benzamide?
N-(4-anilinophenyl)-3-(furan-2-yl)benzamide has a molecular weight of 354.41 g/mol, XLogP of 5.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)-3-(furan-2-yl)benzamide is sourced from PubChem (CID 168528867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).