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

C25H20N2O3 — CID 2286846

IUPACN-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1)c1ccco1
InChIInChI=1S/C25H20N2O3/c28-24(22-12-7-17-30-22)26-20-13-15-21(16-14-20)27-25(29)23(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-17,23H,(H,26,28)(H,27,29)
InChIKeyBKLAWVCSFFOKQR-UHFFFAOYSA-N
MW396.45 g/mol
LogP5.30
Rot. Bonds6

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

N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide (PubChem CID 2286846) has the molecular formula C25H20N2O3 and a molecular weight of 396.45 g/mol. Its IUPAC name is N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide
PubChem CID2286846
Molecular FormulaC25H20N2O3
Molecular Weight396.45 g/mol
Exact Mass396.15
IUPAC NameN-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1)c1ccco1
InChIInChI=1S/C25H20N2O3/c28-24(22-12-7-17-30-22)26-20-13-15-21(16-14-20)27-25(29)23(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-17,23H,(H,26,28)(H,27,29)
InChIKeyBKLAWVCSFFOKQR-UHFFFAOYSA-N
XLogP5.30
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.45
LogP ≤ 55.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
[4-(furan-2-carbonylamino)phenyl]carbamic acid
CID 18543126
N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide
CID 9450262
N-[4-(methylamino)phenyl]furan-2-carboxamide
CID 63091259
N-[4-[[(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl]amino]phenyl]furan-2-carboxamide
CID 34277955
N-[4-[[2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoyl]amino]phenyl]furan-2-carboxamide
CID 46509472
N-(4-fluorophenyl)furan-2-carboxamide
CID 531893
N-[4-(2-propylpentanoylamino)phenyl]furan-2-carboxamide
CID 804751
N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide
CID 35335039
N-[(2R)-1-anilino-1-oxopropan-2-yl]furan-2-carboxamide
CID 42561606
N-[4-[(2-phenylsulfanylacetyl)amino]phenyl]furan-2-carboxamide
CID 1093493
N-[4-[(Z)-N-[[(2R)-2-hydroxy-2-phenylacetyl]amino]-C-methylcarbonimidoyl]phenyl]furan-2-carboxamide
CID 40568661

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide (CID 2286846) is N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide is O=C(Nc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1)c1ccco1.
What is the InChIKey of N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide?
The InChIKey is BKLAWVCSFFOKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2O3/c28-24(22-12-7-17-30-22)26-20-13-15-21(16-14-20)27-25(29)23(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-17,23H,(H,26,28)(H,27,29).
What are the key properties of N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide?
N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide has a molecular weight of 396.45 g/mol, XLogP of 5.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 2286846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).