2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide

C20H24N2O3S — CID 46603209

IUPAC2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide
SMILESCC1(NC(=O)CNC(c2ccccc2)c2ccccc2)CCS(=O)(=O)C1
InChIInChI=1S/C20H24N2O3S/c1-20(12-13-26(24,25)15-20)22-18(23)14-21-19(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,19,21H,12-15H2,1H3,(H,22,23)
InChIKeyRNQFIPIKFSGDMX-UHFFFAOYSA-N
MW372.49 g/mol
LogP2.06
Rot. Bonds6

About 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide

2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide (PubChem CID 46603209) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide.

Molecular Properties

Compound Name2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide
PubChem CID46603209
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC Name2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide
SMILESCC1(NC(=O)CNC(c2ccccc2)c2ccccc2)CCS(=O)(=O)C1
InChIInChI=1S/C20H24N2O3S/c1-20(12-13-26(24,25)15-20)22-18(23)14-21-19(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,19,21H,12-15H2,1H3,(H,22,23)
InChIKeyRNQFIPIKFSGDMX-UHFFFAOYSA-N
XLogP2.06
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3R)-3-methyl-1,1-dioxothiolan-3-yl]-2-[[(S)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 8640556
N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]-2-[[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]amino]acetamide
CID 8868421
(3R)-4,4,4-trifluoro-N-[(3R)-3-methyl-1,1-dioxothiolan-3-yl]-3-phenylbutanamide
CID 95280249
2-chloro-N-[(1R)-3-[[(3S)-3-methyl-1,1-dioxothiolan-3-yl]amino]-3-oxo-1-phenylpropyl]benzamide
CID 95261853
N-(3-methyl-1,1-dioxothiolan-3-yl)-4-oxo-4-phenylbutanamide
CID 78789298
2-(dibenzylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide
CID 78761765
2-(2-chlorophenoxy)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide
CID 18157918
N-[2-[(3-methyl-1,1-dioxothiolan-3-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 134037980
2-(benzhydrylamino)-N-(1-cyanocyclopentyl)acetamide
CID 7516068
1-N,2-N-bis[(3S)-3-methyl-1,1-dioxothiolan-3-yl]benzene-1,2-dicarboxamide
CID 2362502
[(1S)-1-(2-chlorophenyl)ethyl]-[2-[[(3R)-3-methyl-1,1-dioxothiolan-3-yl]amino]-2-oxoethyl]azanium
CID 8598600
2-hydroxy-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide
CID 16768977

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide?
The IUPAC name of 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide (CID 46603209) is 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide.
What is the SMILES notation for 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide?
The canonical SMILES for 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide is CC1(NC(=O)CNC(c2ccccc2)c2ccccc2)CCS(=O)(=O)C1.
What is the InChIKey of 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide?
The InChIKey is RNQFIPIKFSGDMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-20(12-13-26(24,25)15-20)22-18(23)14-21-19(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,19,21H,12-15H2,1H3,(H,22,23).
What are the key properties of 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide?
2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide has a molecular weight of 372.49 g/mol, XLogP of 2.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide is sourced from PubChem (CID 46603209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).