(2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide

C13H22N2O2 — CID 141027681

IUPAC(2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide
SMILESO=C(CNC(=O)[C@@H]1CCCN1)C1CCCCC1
InChIInChI=1S/C13H22N2O2/c16-12(10-5-2-1-3-6-10)9-15-13(17)11-7-4-8-14-11/h10-11,14H,1-9H2,(H,15,17)/t11-/m0/s1
InChIKeyGWMMFZVLJIUGGC-NSHDSACASA-N
MW238.33 g/mol
LogP1.00
Rot. Bonds4

About (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide

(2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide (PubChem CID 141027681) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide
PubChem CID141027681
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name(2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide
SMILESO=C(CNC(=O)[C@@H]1CCCN1)C1CCCCC1
InChIInChI=1S/C13H22N2O2/c16-12(10-5-2-1-3-6-10)9-15-13(17)11-7-4-8-14-11/h10-11,14H,1-9H2,(H,15,17)/t11-/m0/s1
InChIKeyGWMMFZVLJIUGGC-NSHDSACASA-N
XLogP1.00
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide
CID 18324145
(2S)-N-[2-(hydroxyamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 10419946
N-[2-(cyclopentylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 83620464
N-(2-methylprop-2-enyl)pyrrolidine-2-carboxamide
CID 112703892
N-[2-(cyclopropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 43419759
N-(fluoromethyl)pyrrolidine-2-carboxamide
CID 123273673
(2S)-N-(2-bromoprop-2-enyl)piperidine-2-carboxamide;hydrochloride
CID 119755042
(2S)-N-[2-oxo-2-[8-[[2-[[(2S)-pyrrolidine-2-carbonyl]amino]acetyl]amino]octylamino]ethyl]pyrrolidine-2-carboxamide
CID 102333341
N-[2-(cyclopropylamino)-2-oxoethyl]piperidine-2-carboxamide
CID 43515304
(2R)-N-ethylpyrrolidine-2-carboxamide;molecular hydrogen
CID 178045420
N-(cyclooctylmethyl)piperidine-2-carboxamide;hydrochloride
CID 119299438
N-(cyclobutylmethyl)azepane-2-carboxamide
CID 64564563

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide (CID 141027681) is (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide is O=C(CNC(=O)[C@@H]1CCCN1)C1CCCCC1.
What is the InChIKey of (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide?
The InChIKey is GWMMFZVLJIUGGC-NSHDSACASA-N. The full InChI is InChI=1S/C13H22N2O2/c16-12(10-5-2-1-3-6-10)9-15-13(17)11-7-4-8-14-11/h10-11,14H,1-9H2,(H,15,17)/t11-/m0/s1.
What are the key properties of (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide?
(2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide has a molecular weight of 238.33 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-cyclohexyl-2-oxoethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 141027681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).