(3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide

C15H22N2O — CID 124685796

IUPAC(3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide
SMILESCCc1ccc(CC)c(NC(=O)[C@@H]2CCNC2)c1
InChIInChI=1S/C15H22N2O/c1-3-11-5-6-12(4-2)14(9-11)17-15(18)13-7-8-16-10-13/h5-6,9,13,16H,3-4,7-8,10H2,1-2H3,(H,17,18)/t13-/m1/s1
InChIKeyRMKHCKFYUKFPRD-CYBMUJFWSA-N
MW246.35 g/mol
LogP2.36
Rot. Bonds4

About (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide

(3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide (PubChem CID 124685796) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide
PubChem CID124685796
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name(3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide
SMILESCCc1ccc(CC)c(NC(=O)[C@@H]2CCNC2)c1
InChIInChI=1S/C15H22N2O/c1-3-11-5-6-12(4-2)14(9-11)17-15(18)13-7-8-16-10-13/h5-6,9,13,16H,3-4,7-8,10H2,1-2H3,(H,17,18)/t13-/m1/s1
InChIKeyRMKHCKFYUKFPRD-CYBMUJFWSA-N
XLogP2.36
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-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

N-(2-ethylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119265832
(3R)-N-(2-methylphenyl)pyrrolidine-3-carboxamide
CID 94915623
N-(4-ethyl-1H-pyrazol-5-yl)pyrrolidine-3-carboxamide
CID 104619200
N-[2-(methoxymethyl)phenyl]pyrrolidine-3-carboxamide
CID 63007076
N-[2-methyl-3-(propanoylamino)phenyl]pyrrolidine-3-carboxamide
CID 63006819
N-[4-(propanoylamino)phenyl]pyrrolidine-3-carboxamide
CID 55151727
N-(5-ethyl-2-methoxyphenyl)cyclopropanecarboxamide
CID 110777232
(3R,4S)-N-(2,5-diethylphenyl)-4-(1-methylpyrazol-4-yl)pyrrolidine-3-carboxamide
CID 120936893
N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 63006645
N-(5-chloro-2-ethylsulfanylphenyl)pyrrolidine-3-carboxamide
CID 119776589
(3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide
CID 94915553
N-(2,3-dimethylphenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119670575

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide?
The IUPAC name of (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide (CID 124685796) is (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide is CCc1ccc(CC)c(NC(=O)[C@@H]2CCNC2)c1.
What is the InChIKey of (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide?
The InChIKey is RMKHCKFYUKFPRD-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-11-5-6-12(4-2)14(9-11)17-15(18)13-7-8-16-10-13/h5-6,9,13,16H,3-4,7-8,10H2,1-2H3,(H,17,18)/t13-/m1/s1.
What are the key properties of (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide?
(3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2,5-diethylphenyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 124685796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).