[(2S)-2-(azetidin-1-yl)cyclohexyl]methanol

C10H19NO — CID 58117124

IUPAC[(2S)-2-(azetidin-1-yl)cyclohexyl]methanol
SMILESOCC1CCCC[C@@H]1N1CCC1
InChIInChI=1S/C10H19NO/c12-8-9-4-1-2-5-10(9)11-6-3-7-11/h9-10,12H,1-8H2/t9?,10-/m0/s1
InChIKeyZFUMFZRATWLSLH-AXDSSHIGSA-N
MW169.27 g/mol
LogP1.24
Rot. Bonds2

About [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol

[(2S)-2-(azetidin-1-yl)cyclohexyl]methanol (PubChem CID 58117124) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol.

Molecular Properties

Compound Name[(2S)-2-(azetidin-1-yl)cyclohexyl]methanol
PubChem CID58117124
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name[(2S)-2-(azetidin-1-yl)cyclohexyl]methanol
SMILESOCC1CCCC[C@@H]1N1CCC1
InChIInChI=1S/C10H19NO/c12-8-9-4-1-2-5-10(9)11-6-3-7-11/h9-10,12H,1-8H2/t9?,10-/m0/s1
InChIKeyZFUMFZRATWLSLH-AXDSSHIGSA-N
XLogP1.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]methanol
CID 11019091
[2-(azepan-1-yl)cyclopentyl]methanol
CID 106364698
[2-(3,3-dipropylazetidin-1-yl)cyclohexyl]methanol
CID 114179213
[2-(2-azaspiro[3.5]nonan-2-yl)cyclohexyl]methanol
CID 114179212
[2-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-ylamino)cyclohexyl]methanol
CID 114178522
[1-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]piperidin-2-yl]methanol;dihydrochloride
CID 52994083
1-ethyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
CID 20980731
(2-piperidin-1-ylcyclopropyl)methanol
CID 130678340
[2-(3-ethylazetidin-1-yl)cyclopentyl]methanol
CID 106364703
2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]acetic acid
CID 131186064
2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethanamine;dihydrochloride
CID 50944349
[(9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanamine;hydrochloride
CID 119056746

Frequently Asked Questions

What is the IUPAC name of [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol?
The IUPAC name of [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol (CID 58117124) is [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol.
What is the SMILES notation for [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol?
The canonical SMILES for [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol is OCC1CCCC[C@@H]1N1CCC1.
What is the InChIKey of [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol?
The InChIKey is ZFUMFZRATWLSLH-AXDSSHIGSA-N. The full InChI is InChI=1S/C10H19NO/c12-8-9-4-1-2-5-10(9)11-6-3-7-11/h9-10,12H,1-8H2/t9?,10-/m0/s1.
What are the key properties of [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol?
[(2S)-2-(azetidin-1-yl)cyclohexyl]methanol has a molecular weight of 169.27 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-(azetidin-1-yl)cyclohexyl]methanol is sourced from PubChem (CID 58117124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).