(2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide

C20H22N2O2 — CID 51605166

IUPAC(2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide
SMILESCCc1ccccc1NC(=O)[C@H]1CCCN1C(=O)c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-2-15-9-6-7-12-17(15)21-19(23)18-13-8-14-22(18)20(24)16-10-4-3-5-11-16/h3-7,9-12,18H,2,8,13-14H2,1H3,(H,21,23)/t18-/m1/s1
InChIKeyUJIRUJYGEFXGLD-GOSISDBHSA-N
MW322.41 g/mol
LogP3.49
Rot. Bonds4

About (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide

(2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide (PubChem CID 51605166) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide
PubChem CID51605166
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name(2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide
SMILESCCc1ccccc1NC(=O)[C@H]1CCCN1C(=O)c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-2-15-9-6-7-12-17(15)21-19(23)18-13-8-14-22(18)20(24)16-10-4-3-5-11-16/h3-7,9-12,18H,2,8,13-14H2,1H3,(H,21,23)/t18-/m1/s1
InChIKeyUJIRUJYGEFXGLD-GOSISDBHSA-N
XLogP3.49
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-benzoyl-N-(2-fluorophenyl)pyrrolidine-2-carboxamide
CID 51605160
(2S)-1-benzoyl-N-(2-fluorophenyl)pyrrolidine-2-carboxamide
CID 51605159
(2S)-1-benzoyl-N-(4-ethylphenyl)pyrrolidine-2-carboxamide
CID 92668243
1-benzoyl-N-(3-chloro-2-methylphenyl)pyrrolidine-2-carboxamide
CID 46756268
2-[2-[(1-acetylpyrrolidine-2-carbonyl)amino]phenyl]acetic acid
CID 119353114
(2S)-1-benzoyl-N-(4-ethoxyphenyl)pyrrolidine-2-carboxamide
CID 92668241
1-(4-fluorobenzoyl)-N-(2-fluorophenyl)pyrrolidine-2-carboxamide
CID 46756299
(2S)-1-benzoyl-N-methoxypyrrolidine-2-carboxamide
CID 11345650
1-benzoyl-N-[4-[2-(dimethylamino)-2-oxoethyl]phenyl]pyrrolidine-2-carboxamide
CID 136577370
(2S)-1-(4-methylbenzoyl)-N-phenylpyrrolidine-2-carboxamide
CID 92668343
1-benzoyl-N-(2,6-difluorophenyl)pyrrolidine-2-carboxamide
CID 46756263
1-benzoyl-N-[2-(methylamino)ethyl]pyrrolidine-2-carboxamide
CID 119503511

Frequently Asked Questions

What is the IUPAC name of (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide (CID 51605166) is (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide is CCc1ccccc1NC(=O)[C@H]1CCCN1C(=O)c1ccccc1.
What is the InChIKey of (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide?
The InChIKey is UJIRUJYGEFXGLD-GOSISDBHSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-2-15-9-6-7-12-17(15)21-19(23)18-13-8-14-22(18)20(24)16-10-4-3-5-11-16/h3-7,9-12,18H,2,8,13-14H2,1H3,(H,21,23)/t18-/m1/s1.
What are the key properties of (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide?
(2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide has a molecular weight of 322.41 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-benzoyl-N-(2-ethylphenyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 51605166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).