N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide

C26H22N2O3 — CID 9450262

IUPACN-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide
SMILESO=C(NCC(c1ccccc1)c1ccccc1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C26H22N2O3/c29-25(21-13-15-22(16-14-21)28-26(30)24-12-7-17-31-24)27-18-23(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-17,23H,18H2,(H,27,29)(H,28,30)
InChIKeySIUNFSILKKCMQO-UHFFFAOYSA-N
MW410.47 g/mol
LogP5.09
Rot. Bonds7

About N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide

N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide (PubChem CID 9450262) has the molecular formula C26H22N2O3 and a molecular weight of 410.47 g/mol. Its IUPAC name is N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide
PubChem CID9450262
Molecular FormulaC26H22N2O3
Molecular Weight410.47 g/mol
Exact Mass410.16
IUPAC NameN-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide
SMILESO=C(NCC(c1ccccc1)c1ccccc1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C26H22N2O3/c29-25(21-13-15-22(16-14-21)28-26(30)24-12-7-17-31-24)27-18-23(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-17,23H,18H2,(H,27,29)(H,28,30)
InChIKeySIUNFSILKKCMQO-UHFFFAOYSA-N
XLogP5.09
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.47
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[[(2R)-2-(dimethylamino)-3-phenylpropyl]carbamoyl]phenyl]furan-2-carboxamide
CID 40820384
N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide
CID 2286846
N-[4-(furan-2-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 976453
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
[(2S)-2-[[4-(furan-2-carbonylamino)benzoyl]amino]-2-phenylethyl]-dimethylazanium
CID 8937893
N-[4-[(4-propan-2-ylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 1114254
N-[4-[[[4-(2-phenylethynyl)benzoyl]amino]methyl]phenyl]furan-2-carboxamide
CID 24618603
N-[4-[3-(diethylamino)propylcarbamoyl]phenyl]furan-2-carboxamide
CID 17407524
N-[4-[(4-acetamidophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 24628897
N-[4-[(2-methylphenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 9184242
[4-(furan-2-carbonylamino)phenyl]carbamic acid
CID 18543126
N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
CID 823701

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide (CID 9450262) is N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide is O=C(NCC(c1ccccc1)c1ccccc1)c1ccc(NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide?
The InChIKey is SIUNFSILKKCMQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O3/c29-25(21-13-15-22(16-14-21)28-26(30)24-12-7-17-31-24)27-18-23(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-17,23H,18H2,(H,27,29)(H,28,30).
What are the key properties of N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide?
N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide has a molecular weight of 410.47 g/mol, XLogP of 5.09, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 9450262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).