2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide

C16H22N4O3 — CID 125162032

IUPAC2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide
SMILESCN(C)C(=O)NCC(=O)NC[C@H]1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C16H22N4O3/c1-19(2)16(23)18-10-14(21)17-9-12-8-15(22)20(11-12)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H,17,21)(H,18,23)/t12-/m1/s1
InChIKeyJXYWFEMJSDVNCS-GFCCVEGCSA-N
MW318.38 g/mol
LogP0.43
Rot. Bonds5

About 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide

2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide (PubChem CID 125162032) has the molecular formula C16H22N4O3 and a molecular weight of 318.38 g/mol. Its IUPAC name is 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide
PubChem CID125162032
Molecular FormulaC16H22N4O3
Molecular Weight318.38 g/mol
Exact Mass318.17
IUPAC Name2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide
SMILESCN(C)C(=O)NCC(=O)NC[C@H]1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C16H22N4O3/c1-19(2)16(23)18-10-14(21)17-9-12-8-15(22)20(11-12)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H,17,21)(H,18,23)/t12-/m1/s1
InChIKeyJXYWFEMJSDVNCS-GFCCVEGCSA-N
XLogP0.43
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]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

3-cyclopentyl-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide
CID 16918197
2-(3-chlorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]acetamide
CID 110737325
N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]-2,2-diphenylacetamide
CID 16918291
2-(2-methoxyphenoxy)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]acetamide
CID 16918272
N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]-2-propylpentanamide
CID 16918191
4-methyl-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]benzamide
CID 16918211
1,1-dimethyl-3-(5-oxo-1-phenylpyrrolidin-3-yl)urea
CID 18564044
N-[[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]methyl]-2-phenylacetamide
CID 40895899
methyl 2-[(5-oxo-1-phenylpyrrolidin-3-yl)methylcarbamoyl]benzoate
CID 16918311
2-methylsulfanyl-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]benzamide
CID 16918317
3-methyl-N-[[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]benzamide
CID 40876165
2-naphthalen-2-yloxy-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]acetamide
CID 16918271

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide?
The IUPAC name of 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide (CID 125162032) is 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide.
What is the SMILES notation for 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide?
The canonical SMILES for 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide is CN(C)C(=O)NCC(=O)NC[C@H]1CC(=O)N(c2ccccc2)C1.
What is the InChIKey of 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide?
The InChIKey is JXYWFEMJSDVNCS-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H22N4O3/c1-19(2)16(23)18-10-14(21)17-9-12-8-15(22)20(11-12)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H,17,21)(H,18,23)/t12-/m1/s1.
What are the key properties of 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide?
2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide has a molecular weight of 318.38 g/mol, XLogP of 0.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylcarbamoylamino)-N-[[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]acetamide is sourced from PubChem (CID 125162032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).