(2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide

C12H22N2O — CID 107413261

IUPAC(2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide
SMILESCC1CCC(CNC(=O)[C@@H]2CCCN2)C1
InChIInChI=1S/C12H22N2O/c1-9-4-5-10(7-9)8-14-12(15)11-3-2-6-13-11/h9-11,13H,2-8H2,1H3,(H,14,15)/t9?,10?,11-/m0/s1
InChIKeyIEQDDBHKZIHDEA-ILDUYXDCSA-N
MW210.32 g/mol
LogP1.29
Rot. Bonds3

About (2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide

(2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide (PubChem CID 107413261) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is (2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide
PubChem CID107413261
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name(2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide
SMILESCC1CCC(CNC(=O)[C@@H]2CCCN2)C1
InChIInChI=1S/C12H22N2O/c1-9-4-5-10(7-9)8-14-12(15)11-3-2-6-13-11/h9-11,13H,2-8H2,1H3,(H,14,15)/t9?,10?,11-/m0/s1
InChIKeyIEQDDBHKZIHDEA-ILDUYXDCSA-N
XLogP1.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-[(3-methylcyclohexyl)methyl]piperidine-2-carboxamide
CID 114130671
4-methyl-N-[(4-methylcyclohexyl)methyl]piperidine-2-carboxamide
CID 114424006
N-[(4-ethylcyclohexyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119300473
(2R)-N-[(2-methylcyclopropyl)methyl]pyrrolidine-2-carboxamide
CID 103795243
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrrolidine-2-carboxamide
CID 54898994
N-[(3-methylcyclopentyl)methyl]-5-(trifluoromethyl)piperidine-2-carboxamide
CID 107413534
(2R)-N-(thian-4-ylmethyl)pyrrolidine-2-carboxamide
CID 103796004
(2S)-N-(thian-4-ylmethyl)pyrrolidine-2-carboxamide
CID 103796007
(2R)-N-[(4-hydroxycyclohexyl)methyl]piperidine-2-carboxamide
CID 106135357
(2R)-N-(cyclopropylmethyl)azetidine-2-carboxamide;hydrochloride
CID 130670141
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-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide (CID 107413261) is (2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide is CC1CCC(CNC(=O)[C@@H]2CCCN2)C1.
What is the InChIKey of (2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is IEQDDBHKZIHDEA-ILDUYXDCSA-N. The full InChI is InChI=1S/C12H22N2O/c1-9-4-5-10(7-9)8-14-12(15)11-3-2-6-13-11/h9-11,13H,2-8H2,1H3,(H,14,15)/t9?,10?,11-/m0/s1.
What are the key properties of (2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide?
(2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 210.32 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[(3-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 107413261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).