3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide

C22H21N3O2 — CID 26313248

IUPAC3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide
SMILESNC(=O)Nc1cccc(C(=O)NCC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C22H21N3O2/c23-22(27)25-19-13-7-12-18(14-19)21(26)24-15-20(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-14,20H,15H2,(H,24,26)(H3,23,25,27)
InChIKeyVMUGUNRIBBJGDZ-UHFFFAOYSA-N
MW359.43 g/mol
LogP3.74
Rot. Bonds6

About 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide

3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide (PubChem CID 26313248) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide.

Molecular Properties

Compound Name3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide
PubChem CID26313248
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC Name3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide
SMILESNC(=O)Nc1cccc(C(=O)NCC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C22H21N3O2/c23-22(27)25-19-13-7-12-18(14-19)21(26)24-15-20(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-14,20H,15H2,(H,24,26)(H3,23,25,27)
InChIKeyVMUGUNRIBBJGDZ-UHFFFAOYSA-N
XLogP3.74
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 53.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-benzamidoethyl)-3-(carbamoylamino)benzamide
CID 38205035
4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide
CID 30870123
N-(3-aminobutyl)-3-(carbamoylamino)benzamide
CID 119496000
3-acetamido-N-[(2S)-2-(dimethylamino)-2-phenylethyl]benzamide
CID 27230301
3-acetamido-N-[2-(dimethylamino)-2-phenylethyl]benzamide
CID 42910974
3-(carbamoylamino)-N-[3-(N-methylanilino)propyl]benzamide
CID 37315817
3-(carbamoylamino)-N-[(2-fluorophenyl)methyl]benzamide
CID 8870626
3-(carbamoylamino)-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 78815862
3-(carbamoylamino)-N-[2-(2-fluorophenyl)ethyl]benzamide
CID 9474305
3-[3-[[3-(carbamoylamino)benzoyl]amino]phenyl]sulfonyl-3-phenylpropanoic acid
CID 22268545
3-[2-[[3-(carbamoylamino)benzoyl]amino]phenyl]sulfanyl-3-phenylpropanoic acid
CID 10181425
2-phenyl-3-[[3-(propan-2-ylcarbamoylamino)benzoyl]amino]propanoic acid
CID 119254635

Frequently Asked Questions

What is the IUPAC name of 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide?
The IUPAC name of 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide (CID 26313248) is 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide.
What is the SMILES notation for 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide?
The canonical SMILES for 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide is NC(=O)Nc1cccc(C(=O)NCC(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide?
The InChIKey is VMUGUNRIBBJGDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c23-22(27)25-19-13-7-12-18(14-19)21(26)24-15-20(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-14,20H,15H2,(H,24,26)(H3,23,25,27).
What are the key properties of 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide?
3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide has a molecular weight of 359.43 g/mol, XLogP of 3.74, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide is sourced from PubChem (CID 26313248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).