N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide

C26H23N3O3 — CID 35335039

IUPACN-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide
SMILESO=C(NCc1ccco1)Nc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H23N3O3/c30-25(24(19-8-3-1-4-9-19)20-10-5-2-6-11-20)28-21-13-15-22(16-14-21)29-26(31)27-18-23-12-7-17-32-23/h1-17,24H,18H2,(H,28,30)(H2,27,29,31)
InChIKeyGVRQASFSALQJSL-UHFFFAOYSA-N
MW425.49 g/mol
LogP5.37
Rot. Bonds7

About N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide

N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide (PubChem CID 35335039) has the molecular formula C26H23N3O3 and a molecular weight of 425.49 g/mol. Its IUPAC name is N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide
PubChem CID35335039
Molecular FormulaC26H23N3O3
Molecular Weight425.49 g/mol
Exact Mass425.17
IUPAC NameN-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide
SMILESO=C(NCc1ccco1)Nc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H23N3O3/c30-25(24(19-8-3-1-4-9-19)20-10-5-2-6-11-20)28-21-13-15-22(16-14-21)29-26(31)27-18-23-12-7-17-32-23/h1-17,24H,18H2,(H,28,30)(H2,27,29,31)
InChIKeyGVRQASFSALQJSL-UHFFFAOYSA-N
XLogP5.37
TPSA83.37 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.49
LogP ≤ 55.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2-phenyl-2-pyrrolidin-1-ylacetamide
CID 86885500
(2R)-2-acetamido-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]propanamide
CID 29367214
N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide
CID 2286846
1-[4-(furan-2-ylmethylamino)phenyl]-3-phenylurea
CID 112981834
2-(furan-2-ylmethylamino)-N-phenylpropanamide
CID 43083282
2-(furan-2-ylmethylcarbamoylamino)-2-phenylacetic acid
CID 61188974
(2R)-2-cyano-N-(furan-2-ylmethyl)-2-phenylacetamide
CID 951669
tert-butyl N-[1-[4-(furan-2-ylmethylcarbamoylamino)anilino]-1-oxopropan-2-yl]carbamate
CID 55560299
N-[(2R)-1-[4-(furan-2-ylmethylcarbamoylamino)anilino]-1-oxopropan-2-yl]cyclopentanecarboxamide
CID 95145619
4-(difluoromethoxy)-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]benzamide
CID 35335808
1-N-(furan-2-ylmethyl)-4-N-phenylbenzene-1,4-dicarboxamide
CID 109046573
(2S)-N-(furan-2-ylmethyl)-2-phenylbutanamide
CID 40538690

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide?
The IUPAC name of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide (CID 35335039) is N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide is O=C(NCc1ccco1)Nc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide?
The InChIKey is GVRQASFSALQJSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3O3/c30-25(24(19-8-3-1-4-9-19)20-10-5-2-6-11-20)28-21-13-15-22(16-14-21)29-26(31)27-18-23-12-7-17-32-23/h1-17,24H,18H2,(H,28,30)(H2,27,29,31).
What are the key properties of N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide?
N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide has a molecular weight of 425.49 g/mol, XLogP of 5.37, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-2,2-diphenylacetamide is sourced from PubChem (CID 35335039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).