1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol

C11H21NO2 — CID 130681778

IUPAC1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol
SMILESCC1(O)CCCC1(C)N1CCC(O)C1
InChIInChI=1S/C11H21NO2/c1-10(5-3-6-11(10,2)14)12-7-4-9(13)8-12/h9,13-14H,3-8H2,1-2H3
InChIKeyBYQFBJOSPRAGOD-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.75
Rot. Bonds1

About 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol

1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol (PubChem CID 130681778) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol
PubChem CID130681778
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol
SMILESCC1(O)CCCC1(C)N1CCC(O)C1
InChIInChI=1S/C11H21NO2/c1-10(5-3-6-11(10,2)14)12-7-4-9(13)8-12/h9,13-14H,3-8H2,1-2H3
InChIKeyBYQFBJOSPRAGOD-UHFFFAOYSA-N
XLogP0.75
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3R)-3-aminopyrrolidin-1-yl]-1,2-dimethylcyclopentan-1-ol
CID 130655297
(4R)-2-(2-hydroxy-1,2-dimethylcyclopentyl)-1,2-oxazolidin-4-ol
CID 130681779
1-(1-methylcyclopentyl)piperidin-4-ol
CID 67281081
1-(1-methylcyclooctyl)piperidin-4-ol
CID 67281005
1-[1-(4-methylphenyl)cyclobutyl]pyrrolidin-3-ol
CID 59020003
(3S)-1-[4,4-dimethyl-1-(methylaminomethyl)cyclohexyl]pyrrolidin-3-ol
CID 58689270
[(3R)-3-hydroxypyrrolidin-1-yl]-(1-methylcycloheptyl)methanone
CID 110027381
[(3S)-3-hydroxypyrrolidin-1-yl]-(1-methylcyclopropyl)methanone
CID 130162770
2-methylcyclopentane-1,1,2-triol
CID 139968116
(1-aminocyclobutyl)-[(3S)-3-hydroxypyrrolidin-1-yl]methanone
CID 107217407
bis(3-methyl-1-propan-2-ylazetidin-3-ol);bis((3S)-3-methyl-1-propan-2-ylpyrrolidin-3-ol);1-propan-2-ylpyrrolidine;bis((3S)-1-propan-2-ylpyrrolidin-3-ol)
CID 167683219
(3R)-3-hydroxy-N-(1-methylcyclopropyl)pyrrolidine-1-carbothioamide
CID 130891115

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol?
The IUPAC name of 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol (CID 130681778) is 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol.
What is the SMILES notation for 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol?
The canonical SMILES for 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol is CC1(O)CCCC1(C)N1CCC(O)C1.
What is the InChIKey of 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol?
The InChIKey is BYQFBJOSPRAGOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-10(5-3-6-11(10,2)14)12-7-4-9(13)8-12/h9,13-14H,3-8H2,1-2H3.
What are the key properties of 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol?
1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol has a molecular weight of 199.29 g/mol, XLogP of 0.75, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxy-1,2-dimethylcyclopentyl)pyrrolidin-3-ol is sourced from PubChem (CID 130681778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).