3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one

C11H19NO2 — CID 20647908

IUPAC3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one
SMILESCC1CCC(C(O)C2CCNC2=O)C1
InChIInChI=1S/C11H19NO2/c1-7-2-3-8(6-7)10(13)9-4-5-12-11(9)14/h7-10,13H,2-6H2,1H3,(H,12,14)
InChIKeyKHYWLJXGTGTTGK-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.92
Rot. Bonds2

About 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one

3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one (PubChem CID 20647908) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one
PubChem CID20647908
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one
SMILESCC1CCC(C(O)C2CCNC2=O)C1
InChIInChI=1S/C11H19NO2/c1-7-2-3-8(6-7)10(13)9-4-5-12-11(9)14/h7-10,13H,2-6H2,1H3,(H,12,14)
InChIKeyKHYWLJXGTGTTGK-UHFFFAOYSA-N
XLogP0.92
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-hydroxyethyl)pyrrolidin-2-one
CID 559138
(3,5-dimethylcyclohexyl)-(3-methylcyclopentyl)methanol
CID 65402149
3-propan-2-ylpyrrolidin-2-one;(3S)-3-propan-2-ylpyrrolidin-2-one;(3R)-3-propan-2-ylpyrrolidin-2-one
CID 158680886
[(1R,3S)-3-methylcyclopentyl]methanediol
CID 163440646
3-[hydroxy(phenyl)methyl]pyrrolidin-2-one
CID 142674016
1-(3-methylcyclopentyl)ethanol
CID 12501270
3-tridecan-7-ylpyrrolidin-2-one
CID 167077017
5-methyl-3-(methylamino)azepan-2-one
CID 22985155
(3-methylcyclohexyl)-piperidin-4-ylmethanol
CID 80560388
(3S)-3-(1-amino-2,2,2-trifluoroethyl)pyrrolidin-2-one
CID 90047014
1-(3-methylcyclopentyl)propan-1-ol
CID 65400346
(4-methylcyclohexyl)-piperidin-4-ylmethanol
CID 80560052

Frequently Asked Questions

What is the IUPAC name of 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one?
The IUPAC name of 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one (CID 20647908) is 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one.
What is the SMILES notation for 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one?
The canonical SMILES for 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one is CC1CCC(C(O)C2CCNC2=O)C1.
What is the InChIKey of 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one?
The InChIKey is KHYWLJXGTGTTGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-7-2-3-8(6-7)10(13)9-4-5-12-11(9)14/h7-10,13H,2-6H2,1H3,(H,12,14).
What are the key properties of 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one?
3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one has a molecular weight of 197.28 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[hydroxy-(3-methylcyclopentyl)methyl]pyrrolidin-2-one is sourced from PubChem (CID 20647908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).