2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide

C20H23N3O2 — CID 72875533

IUPAC2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide
SMILESCNC(=O)C1CCCN1C(=O)Nc1cccc(-c2ccccc2C)c1
InChIInChI=1S/C20H23N3O2/c1-14-7-3-4-10-17(14)15-8-5-9-16(13-15)22-20(25)23-12-6-11-18(23)19(24)21-2/h3-5,7-10,13,18H,6,11-12H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyRIKIQCYPTMGFEZ-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.40
Rot. Bonds3

About 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide

2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide (PubChem CID 72875533) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide
PubChem CID72875533
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide
SMILESCNC(=O)C1CCCN1C(=O)Nc1cccc(-c2ccccc2C)c1
InChIInChI=1S/C20H23N3O2/c1-14-7-3-4-10-17(14)15-8-5-9-16(13-15)22-20(25)23-12-6-11-18(23)19(24)21-2/h3-5,7-10,13,18H,6,11-12H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyRIKIQCYPTMGFEZ-UHFFFAOYSA-N
XLogP3.40
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-(3-acetylphenyl)-2-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 651368
(2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide
CID 1443151
(2R)-1-N-phenyl-2-N-(2-phenylphenyl)pyrrolidine-1,2-dicarboxamide
CID 51687470
(2S)-1-N-[4-(3-methoxyphenyl)phenyl]-2-N-methylpyrrolidine-1,2-dicarboxamide
CID 97452585
1-N-(3-methoxyphenyl)-2-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 3219782
1-N-(3-methylphenyl)-2-N-propan-2-ylpyrrolidine-1,2-dicarboxamide
CID 3230204
(2R)-2-N-(3-acetamidophenyl)-1-N-(3-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 1442935
2-N-tert-butyl-1-N-(3-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 3697683
(2R)-1-N-(3-methylphenyl)-2-N-propan-2-ylpyrrolidine-1,2-dicarboxamide
CID 1442922
1-[[4-[2-chloro-4-(2-methylphenyl)anilino]phenyl]carbamoyl]pyrrolidine-2-carboxylic acid
CID 155134336
(2S)-1-N,2-N-bis(3-chlorophenyl)pyrrolidine-1,2-dicarboxamide
CID 1445725
(2S)-1-N-(3-fluorophenyl)-2-N-phenylpyrrolidine-1,2-dicarboxamide
CID 1443127

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide?
The IUPAC name of 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide (CID 72875533) is 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide.
What is the SMILES notation for 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide?
The canonical SMILES for 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide is CNC(=O)C1CCCN1C(=O)Nc1cccc(-c2ccccc2C)c1.
What is the InChIKey of 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide?
The InChIKey is RIKIQCYPTMGFEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-14-7-3-4-10-17(14)15-8-5-9-16(13-15)22-20(25)23-12-6-11-18(23)19(24)21-2/h3-5,7-10,13,18H,6,11-12H2,1-2H3,(H,21,24)(H,22,25).
What are the key properties of 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide?
2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide has a molecular weight of 337.42 g/mol, XLogP of 3.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-1-N-[3-(2-methylphenyl)phenyl]pyrrolidine-1,2-dicarboxamide is sourced from PubChem (CID 72875533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).