(2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide

C13H24N2O — CID 103797869

IUPAC(2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide
SMILESCCC1(CNC(=O)[C@@H]2CCCN2)CCCC1
InChIInChI=1S/C13H24N2O/c1-2-13(7-3-4-8-13)10-15-12(16)11-6-5-9-14-11/h11,14H,2-10H2,1H3,(H,15,16)/t11-/m0/s1
InChIKeyJJBZMEKTXMPYME-NSHDSACASA-N
MW224.35 g/mol
LogP1.83
Rot. Bonds4

About (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide

(2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide (PubChem CID 103797869) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide
PubChem CID103797869
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name(2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide
SMILESCCC1(CNC(=O)[C@@H]2CCCN2)CCCC1
InChIInChI=1S/C13H24N2O/c1-2-13(7-3-4-8-13)10-15-12(16)11-6-5-9-14-11/h11,14H,2-10H2,1H3,(H,15,16)/t11-/m0/s1
InChIKeyJJBZMEKTXMPYME-NSHDSACASA-N
XLogP1.83
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-[(1-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide
CID 63829240
N-[[1-(hydroxymethyl)cyclopentyl]methyl]piperidine-2-carboxamide
CID 113293938
(2S)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]piperidine-2-carboxamide
CID 104914457
N-[(1-ethylcyclopentyl)methyl]thiomorpholine-3-carboxamide
CID 114125067
N-[(1-ethylcyclopentyl)methyl]-6-methylpiperidine-2-carboxamide
CID 114125672
(2R)-N-ethylpyrrolidine-2-carboxamide;molecular hydrogen
CID 178045420
N-[(1-ethylcyclopentyl)methyl]piperidine-3-carboxamide
CID 103797871
N-propylpyrrolidine-2-carboxamide
CID 4984185
N-[(1-ethylcyclopentyl)methyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119812251
4-methyl-1-[[[(2R)-pyrrolidine-2-carbonyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 104901353
N-[(1-ethylcyclopentyl)methyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 103797849
(2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride
CID 119682228

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide (CID 103797869) is (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide is CCC1(CNC(=O)[C@@H]2CCCN2)CCCC1.
What is the InChIKey of (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is JJBZMEKTXMPYME-NSHDSACASA-N. The full InChI is InChI=1S/C13H24N2O/c1-2-13(7-3-4-8-13)10-15-12(16)11-6-5-9-14-11/h11,14H,2-10H2,1H3,(H,15,16)/t11-/m0/s1.
What are the key properties of (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide?
(2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 103797869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).