(2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide

C20H22FN3O2 — CID 1443151

IUPAC(2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide
SMILESCc1cccc(C)c1NC(=O)[C@H]1CCCN1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C20H22FN3O2/c1-13-6-3-7-14(2)18(13)23-19(25)17-10-5-11-24(17)20(26)22-16-9-4-8-15(21)12-16/h3-4,6-9,12,17H,5,10-11H2,1-2H3,(H,22,26)(H,23,25)/t17-/m1/s1
InChIKeyUCFDFLOSEBTPPO-QGZVFWFLSA-N
MW355.41 g/mol
LogP4.08
Rot. Bonds3

About (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide

(2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide (PubChem CID 1443151) has the molecular formula C20H22FN3O2 and a molecular weight of 355.41 g/mol. Its IUPAC name is (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide.

Molecular Properties

Compound Name(2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide
PubChem CID1443151
Molecular FormulaC20H22FN3O2
Molecular Weight355.41 g/mol
Exact Mass355.17
IUPAC Name(2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide
SMILESCc1cccc(C)c1NC(=O)[C@H]1CCCN1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C20H22FN3O2/c1-13-6-3-7-14(2)18(13)23-19(25)17-10-5-11-24(17)20(26)22-16-9-4-8-15(21)12-16/h3-4,6-9,12,17H,5,10-11H2,1-2H3,(H,22,26)(H,23,25)/t17-/m1/s1
InChIKeyUCFDFLOSEBTPPO-QGZVFWFLSA-N
XLogP4.08
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.41
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-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

Related Compounds

(2S)-1-N-(3-fluorophenyl)-2-N-phenylpyrrolidine-1,2-dicarboxamide
CID 1443127
(2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide
CID 1443076
1-[(3-fluorophenyl)carbamoyl]piperidine-2-carboxylic acid
CID 54980760
2-N-(2,3-dimethylphenyl)-1-N-(4-fluorophenyl)pyrrolidine-1,2-dicarboxamide
CID 3219650
(2R)-1-(3-fluorobenzoyl)-N-(3-fluorophenyl)pyrrolidine-2-carboxamide
CID 51605341
2-[(3-fluorophenyl)carbamoyl]piperidine-1-carboxylic acid
CID 175733290
(2S)-2-N-tert-butyl-1-N-(2,6-dimethylphenyl)pyrrolidine-1,2-dicarboxamide
CID 1443541
(2R)-2-N-(4-fluorophenyl)-1-N-(3-methoxyphenyl)pyrrolidine-1,2-dicarboxamide
CID 1468879
1-N-(3-acetylphenyl)-2-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 651368
(2R)-2-N-(3-acetamidophenyl)-1-N-(3-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 1442935
(2S)-1-N,2-N-bis(3-chlorophenyl)pyrrolidine-1,2-dicarboxamide
CID 1445725
2-N-(4-fluorophenyl)-1-N-phenylpyrrolidine-1,2-dicarboxamide
CID 43814809

Frequently Asked Questions

What is the IUPAC name of (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide?
The IUPAC name of (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide (CID 1443151) is (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide.
What is the SMILES notation for (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide?
The canonical SMILES for (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide is Cc1cccc(C)c1NC(=O)[C@H]1CCCN1C(=O)Nc1cccc(F)c1.
What is the InChIKey of (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide?
The InChIKey is UCFDFLOSEBTPPO-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H22FN3O2/c1-13-6-3-7-14(2)18(13)23-19(25)17-10-5-11-24(17)20(26)22-16-9-4-8-15(21)12-16/h3-4,6-9,12,17H,5,10-11H2,1-2H3,(H,22,26)(H,23,25)/t17-/m1/s1.
What are the key properties of (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide?
(2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide has a molecular weight of 355.41 g/mol, XLogP of 4.08, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide is sourced from PubChem (CID 1443151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).