3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one

C16H23N3O — CID 115379182

IUPAC3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one
SMILESCc1ccc(N2CCC(NC3CC3)C2=O)cc1N(C)C
InChIInChI=1S/C16H23N3O/c1-11-4-7-13(10-15(11)18(2)3)19-9-8-14(16(19)20)17-12-5-6-12/h4,7,10,12,14,17H,5-6,8-9H2,1-3H3
InChIKeyVWPYELUUNYDEPV-UHFFFAOYSA-N
MW273.38 g/mol
LogP1.92
Rot. Bonds4

About 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one

3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one (PubChem CID 115379182) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one.

Molecular Properties

Compound Name3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one
PubChem CID115379182
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one
SMILESCc1ccc(N2CCC(NC3CC3)C2=O)cc1N(C)C
InChIInChI=1S/C16H23N3O/c1-11-4-7-13(10-15(11)18(2)3)19-9-8-14(16(19)20)17-12-5-6-12/h4,7,10,12,14,17H,5-6,8-9H2,1-3H3
InChIKeyVWPYELUUNYDEPV-UHFFFAOYSA-N
XLogP1.92
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one 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

1-[3-(dimethylamino)-4-methylphenyl]-3-(methylamino)pyrrolidin-2-one
CID 115378411
1-(4-chloro-3-methoxyphenyl)-3-(cyclopropylamino)pyrrolidin-2-one
CID 107623351
3-(cyclopropylamino)-1-[3-(dimethylamino)phenyl]piperidin-2-one
CID 115379175
1-[4-(dimethylamino)phenyl]-3-(methylamino)pyrrolidin-2-one
CID 54973015
1-(4-chloro-3-fluorophenyl)-3-(oxan-4-ylamino)pyrrolidin-2-one
CID 75441668
1-(4-fluoro-3-methylphenyl)-3-(propylamino)pyrrolidin-2-one
CID 62812484
1-tert-butyl-3-[1-(3,4-dimethylphenyl)-2-oxopyrrolidin-3-yl]urea
CID 71838832
1-[3-(dimethylamino)-4-methylphenyl]-5-oxopyrrolidine-3-carbonitrile
CID 115379167
2-methylpropyl 4-[[1-(3,4-dichlorophenyl)-2-oxopyrrolidin-3-yl]amino]piperidine-1-carboxylate
CID 86784110
1-(3,4-dichlorophenyl)-3-(methylamino)pyrrolidin-2-one
CID 54353900
N-[1-(3,4-dimethylphenyl)-2-oxopyrrolidin-3-yl]-2,4-dimethylbenzamide
CID 71839041
N-[1-(3,4-dimethylphenyl)-2-oxopyrrolidin-3-yl]-3,5-difluorobenzamide
CID 71839042

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one?
The IUPAC name of 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one (CID 115379182) is 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one.
What is the SMILES notation for 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one?
The canonical SMILES for 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one is Cc1ccc(N2CCC(NC3CC3)C2=O)cc1N(C)C.
What is the InChIKey of 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one?
The InChIKey is VWPYELUUNYDEPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-11-4-7-13(10-15(11)18(2)3)19-9-8-14(16(19)20)17-12-5-6-12/h4,7,10,12,14,17H,5-6,8-9H2,1-3H3.
What are the key properties of 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one?
3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one has a molecular weight of 273.38 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-1-[3-(dimethylamino)-4-methylphenyl]pyrrolidin-2-one is sourced from PubChem (CID 115379182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).