(2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide

C13H19N3O — CID 103813174

IUPAC(2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide
SMILESCN(C)c1ccc(NC(=O)[C@H]2CCCN2)cc1
InChIInChI=1S/C13H19N3O/c1-16(2)11-7-5-10(6-8-11)15-13(17)12-4-3-9-14-12/h5-8,12,14H,3-4,9H2,1-2H3,(H,15,17)/t12-/m1/s1
InChIKeyYDOPBVXABRLVBX-GFCCVEGCSA-N
MW233.31 g/mol
LogP1.44
Rot. Bonds3

About (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide

(2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide (PubChem CID 103813174) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide
PubChem CID103813174
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name(2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide
SMILESCN(C)c1ccc(NC(=O)[C@H]2CCCN2)cc1
InChIInChI=1S/C13H19N3O/c1-16(2)11-7-5-10(6-8-11)15-13(17)12-4-3-9-14-12/h5-8,12,14H,3-4,9H2,1-2H3,(H,15,17)/t12-/m1/s1
InChIKeyYDOPBVXABRLVBX-GFCCVEGCSA-N
XLogP1.44
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide 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)-N-(4-acetamidophenyl)pyrrolidine-2-carboxamide
CID 22691413
(2S)-N-[3-(dimethylamino)phenyl]pyrrolidine-2-carboxamide
CID 113297589
N-(4-aminophenyl)pyrrolidine-2-carboxamide
CID 22034800
methyl N-[4-(pyrrolidine-2-carbonylamino)phenyl]carbamate
CID 43712644
(2S)-N-[4-[ethyl(2-hydroxyethyl)amino]phenyl]pyrrolidine-2-carboxamide
CID 61178516
(2R)-N-(4-iodophenyl)pyrrolidine-2-carboxamide
CID 28881297
(2R)-N-[4-(carbamoylamino)phenyl]pyrrolidine-2-carboxamide
CID 103794450
(2R)-N-(4-chlorophenyl)pyrrolidine-2-carboxamide
CID 7183288
N-[4-(dimethylcarbamoyl)phenyl]piperidine-2-carboxamide
CID 43702382
N-[4-(dimethylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43617089
(2R)-N-[4-(dimethylcarbamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119684891
(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119670939

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide (CID 103813174) is (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide is CN(C)c1ccc(NC(=O)[C@H]2CCCN2)cc1.
What is the InChIKey of (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide?
The InChIKey is YDOPBVXABRLVBX-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H19N3O/c1-16(2)11-7-5-10(6-8-11)15-13(17)12-4-3-9-14-12/h5-8,12,14H,3-4,9H2,1-2H3,(H,15,17)/t12-/m1/s1.
What are the key properties of (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide?
(2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[4-(dimethylamino)phenyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 103813174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).