2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide

C16H21N3O2 — CID 53015935

IUPAC2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
SMILESCc1ccccc1NC(=O)N1CCCC1C(=O)NC1CC1
InChIInChI=1S/C16H21N3O2/c1-11-5-2-3-6-13(11)18-16(21)19-10-4-7-14(19)15(20)17-12-8-9-12/h2-3,5-6,12,14H,4,7-10H2,1H3,(H,17,20)(H,18,21)
InChIKeyMUYBUVQFEVRHIW-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.27
Rot. Bonds3

About 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide

2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide (PubChem CID 53015935) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
PubChem CID53015935
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
SMILESCc1ccccc1NC(=O)N1CCCC1C(=O)NC1CC1
InChIInChI=1S/C16H21N3O2/c1-11-5-2-3-6-13(11)18-16(21)19-10-4-7-14(19)15(20)17-12-8-9-12/h2-3,5-6,12,14H,4,7-10H2,1H3,(H,17,20)(H,18,21)
InChIKeyMUYBUVQFEVRHIW-UHFFFAOYSA-N
XLogP2.27
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 95051482
2-N-tert-butyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 3230177
N-cyclopropyl-1-(2-methylbenzoyl)pyrrolidine-2-carboxamide
CID 47158357
2-N,2-N-dimethyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 53015936
(2R)-2-N-benzyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 1441944
1-(2-methylbenzoyl)-N-(2-methylphenyl)pyrrolidine-2-carboxamide
CID 46744827
(2S)-2-N-cyclopentyl-1-N-phenylpyrrolidine-1,2-dicarboxamide
CID 1468810
1-N-(3-acetylphenyl)-2-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 651368
(2R)-N-cyclopropyl-1-[4-[(2-methylbenzoyl)amino]benzoyl]pyrrolidine-2-carboxamide
CID 92729944
N-cyclopropyl-1-[2-(methylamino)benzoyl]pyrrolidine-2-carboxamide
CID 61378639
N-cyclopropyl-1-(2,3-dimethylbenzoyl)pyrrolidine-2-carboxamide
CID 78857677
2-methyl-N-(2-methylphenyl)piperidine-1-carboxamide
CID 6460442

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide?
The IUPAC name of 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide (CID 53015935) is 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide.
What is the SMILES notation for 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide?
The canonical SMILES for 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide is Cc1ccccc1NC(=O)N1CCCC1C(=O)NC1CC1.
What is the InChIKey of 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide?
The InChIKey is MUYBUVQFEVRHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-11-5-2-3-6-13(11)18-16(21)19-10-4-7-14(19)15(20)17-12-8-9-12/h2-3,5-6,12,14H,4,7-10H2,1H3,(H,17,20)(H,18,21).
What are the key properties of 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide?
2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide has a molecular weight of 287.36 g/mol, XLogP of 2.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-1-N-(2-methylphenyl)pyrrolidine-1,2-dicarboxamide is sourced from PubChem (CID 53015935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).