(2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide

C20H21Cl2N3O2 — CID 25231301

IUPAC(2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide
SMILESCN(Cc1ccc(Cl)cc1)C(=O)[C@H]1CCCN1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C20H21Cl2N3O2/c1-24(13-14-4-6-15(21)7-5-14)19(26)18-3-2-12-25(18)20(27)23-17-10-8-16(22)9-11-17/h4-11,18H,2-3,12-13H2,1H3,(H,23,27)/t18-/m1/s1
InChIKeyLTWNDZFUOLVRMB-GOSISDBHSA-N
MW406.31 g/mol
LogP4.65
Rot. Bonds4

About (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide

(2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide (PubChem CID 25231301) has the molecular formula C20H21Cl2N3O2 and a molecular weight of 406.31 g/mol. Its IUPAC name is (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide.

Molecular Properties

Compound Name(2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide
PubChem CID25231301
Molecular FormulaC20H21Cl2N3O2
Molecular Weight406.31 g/mol
Exact Mass405.10
IUPAC Name(2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide
SMILESCN(Cc1ccc(Cl)cc1)C(=O)[C@H]1CCCN1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C20H21Cl2N3O2/c1-24(13-14-4-6-15(21)7-5-14)19(26)18-3-2-12-25(18)20(27)23-17-10-8-16(22)9-11-17/h4-11,18H,2-3,12-13H2,1H3,(H,23,27)/t18-/m1/s1
InChIKeyLTWNDZFUOLVRMB-GOSISDBHSA-N
XLogP4.65
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.31
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide?
The IUPAC name of (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide (CID 25231301) is (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide.
What is the SMILES notation for (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide?
The canonical SMILES for (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide is CN(Cc1ccc(Cl)cc1)C(=O)[C@H]1CCCN1C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide?
The InChIKey is LTWNDZFUOLVRMB-GOSISDBHSA-N. The full InChI is InChI=1S/C20H21Cl2N3O2/c1-24(13-14-4-6-15(21)7-5-14)19(26)18-3-2-12-25(18)20(27)23-17-10-8-16(22)9-11-17/h4-11,18H,2-3,12-13H2,1H3,(H,23,27)/t18-/m1/s1.
What are the key properties of (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide?
(2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide has a molecular weight of 406.31 g/mol, XLogP of 4.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-N-(4-chlorophenyl)-2-N-[(4-chlorophenyl)methyl]-2-N-methylpyrrolidine-1,2-dicarboxamide is sourced from PubChem (CID 25231301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).