1-(azetidin-3-yl)cyclohexan-1-ol

C9H17NO — CID 130510137

IUPAC1-(azetidin-3-yl)cyclohexan-1-ol
SMILESOC1(C2CNC2)CCCCC1
InChIInChI=1S/C9H17NO/c11-9(8-6-10-7-8)4-2-1-3-5-9/h8,10-11H,1-7H2
InChIKeyNMFLUTHQEMVJKA-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.90
Rot. Bonds1

About 1-(azetidin-3-yl)cyclohexan-1-ol

1-(azetidin-3-yl)cyclohexan-1-ol (PubChem CID 130510137) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-(azetidin-3-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(azetidin-3-yl)cyclohexan-1-ol
PubChem CID130510137
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-(azetidin-3-yl)cyclohexan-1-ol
SMILESOC1(C2CNC2)CCCCC1
InChIInChI=1S/C9H17NO/c11-9(8-6-10-7-8)4-2-1-3-5-9/h8,10-11H,1-7H2
InChIKeyNMFLUTHQEMVJKA-UHFFFAOYSA-N
XLogP0.90
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,3,4,5,6,7,7a-octahydroisoindol-3a-ol
CID 70541295
1-piperidin-3-ylcyclopropan-1-ol;hydrochloride
CID 127264219
(3aS)-1,2,3,4,5,6,7,7a-octahydroinden-3a-ol
CID 102059632
2,3,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-3a-ol;dihydrochloride
CID 170913208
4-cyclohexylpiperidin-4-ol
CID 44598718
(3S,5R)-4-cyclohexyl-3,5-dimethylpiperidin-4-ol
CID 59130993
4-cyclopentylazepan-4-ol
CID 83684103
5-cyclohexyl-2,3,3a,4,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
CID 115026607
3-cyclohexylpyrrolidin-3-ol;hydrochloride
CID 3051561
1-(1-ethylpiperidin-4-yl)cyclohexan-1-ol
CID 115073911
1-(1,1-dioxothian-3-yl)cyclohexan-1-ol
CID 115073913
2-pyrrolidin-3-yl-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
CID 81116218

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)cyclohexan-1-ol?
The IUPAC name of 1-(azetidin-3-yl)cyclohexan-1-ol (CID 130510137) is 1-(azetidin-3-yl)cyclohexan-1-ol.
What is the SMILES notation for 1-(azetidin-3-yl)cyclohexan-1-ol?
The canonical SMILES for 1-(azetidin-3-yl)cyclohexan-1-ol is OC1(C2CNC2)CCCCC1.
What is the InChIKey of 1-(azetidin-3-yl)cyclohexan-1-ol?
The InChIKey is NMFLUTHQEMVJKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c11-9(8-6-10-7-8)4-2-1-3-5-9/h8,10-11H,1-7H2.
What are the key properties of 1-(azetidin-3-yl)cyclohexan-1-ol?
1-(azetidin-3-yl)cyclohexan-1-ol has a molecular weight of 155.24 g/mol, XLogP of 0.90, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)cyclohexan-1-ol is sourced from PubChem (CID 130510137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).