2-(cyclohexylmethyl)pyrrolidin-3-ol

C11H21NO — CID 83828678

IUPAC2-(cyclohexylmethyl)pyrrolidin-3-ol
SMILESOC1CCNC1CC1CCCCC1
InChIInChI=1S/C11H21NO/c13-11-6-7-12-10(11)8-9-4-2-1-3-5-9/h9-13H,1-8H2
InChIKeyPILZVZGDROZCDG-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.68
Rot. Bonds2

About 2-(cyclohexylmethyl)pyrrolidin-3-ol

2-(cyclohexylmethyl)pyrrolidin-3-ol (PubChem CID 83828678) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-(cyclohexylmethyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name2-(cyclohexylmethyl)pyrrolidin-3-ol
PubChem CID83828678
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-(cyclohexylmethyl)pyrrolidin-3-ol
SMILESOC1CCNC1CC1CCCCC1
InChIInChI=1S/C11H21NO/c13-11-6-7-12-10(11)8-9-4-2-1-3-5-9/h9-13H,1-8H2
InChIKeyPILZVZGDROZCDG-UHFFFAOYSA-N
XLogP1.68
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclohexylmethyl)-3-ethylpyrrolidine
CID 4299051
2-(hydroxymethyl)pyrrolidin-3-ol;hydrochloride
CID 73200189
2-(cyclopentylmethyl)-3-(trifluoromethyl)piperidine
CID 106778789
cyclopentadecylmethylcyclopentadecane
CID 91804599
cyclohexylmethylcyclohexane;piperazine
CID 174648338
2-[(cyclopropylamino)methyl]pyrrolidin-3-ol
CID 18179808
(3R,4S)-4-(cyclohexylmethyl)pyrrolidin-3-ol
CID 46939140
(2S)-2-(cyclohexylmethyl)piperidine
CID 51377530
2-(cycloheptylmethyl)piperidine
CID 79006754
(4S,4aR)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-4-ol
CID 22820323
[4-(cyclopentylmethyl)cyclohexyl]methylcycloheptane
CID 140856779
carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+))
CID 162297269

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethyl)pyrrolidin-3-ol?
The IUPAC name of 2-(cyclohexylmethyl)pyrrolidin-3-ol (CID 83828678) is 2-(cyclohexylmethyl)pyrrolidin-3-ol.
What is the SMILES notation for 2-(cyclohexylmethyl)pyrrolidin-3-ol?
The canonical SMILES for 2-(cyclohexylmethyl)pyrrolidin-3-ol is OC1CCNC1CC1CCCCC1.
What is the InChIKey of 2-(cyclohexylmethyl)pyrrolidin-3-ol?
The InChIKey is PILZVZGDROZCDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c13-11-6-7-12-10(11)8-9-4-2-1-3-5-9/h9-13H,1-8H2.
What are the key properties of 2-(cyclohexylmethyl)pyrrolidin-3-ol?
2-(cyclohexylmethyl)pyrrolidin-3-ol has a molecular weight of 183.29 g/mol, XLogP of 1.68, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethyl)pyrrolidin-3-ol is sourced from PubChem (CID 83828678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).