1-(azetidin-3-yl)-2-cyclobutylethanol

C9H17NO — CID 105430410

IUPAC1-(azetidin-3-yl)-2-cyclobutylethanol
SMILESOC(CC1CCC1)C1CNC1
InChIInChI=1S/C9H17NO/c11-9(8-5-10-6-8)4-7-2-1-3-7/h7-11H,1-6H2
InChIKeyFIXHXCXBYHFUDS-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.76
Rot. Bonds3

About 1-(azetidin-3-yl)-2-cyclobutylethanol

1-(azetidin-3-yl)-2-cyclobutylethanol (PubChem CID 105430410) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-2-cyclobutylethanol.

Molecular Properties

Compound Name1-(azetidin-3-yl)-2-cyclobutylethanol
PubChem CID105430410
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-(azetidin-3-yl)-2-cyclobutylethanol
SMILESOC(CC1CCC1)C1CNC1
InChIInChI=1S/C9H17NO/c11-9(8-5-10-6-8)4-7-2-1-3-7/h7-11H,1-6H2
InChIKeyFIXHXCXBYHFUDS-UHFFFAOYSA-N
XLogP0.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(azetidin-3-yl)-2-cyclopropylethanol
CID 105428286
2-cyclobutyl-1-piperidin-3-ylethanol
CID 105440851
(1R)-2-cyclopropyl-1-[(3S)-piperidin-3-yl]ethanol
CID 124570391
2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol
CID 164654555
1-cyclobutyl-2-cyclopropylethanol
CID 64986544
2-cyclopropyl-1-piperidin-4-ylethanol
CID 67828644
2-cyclopentyl-1-(2-methylcyclopentyl)ethanol
CID 107192189
2-cyclobutyl-1-(3-ethylcyclohexyl)ethanol
CID 65457880
2-cyclobutyl-1-(1,1-dioxothian-2-yl)ethanol
CID 115802354
1-amino-3-cyclobutylpropan-2-ol
CID 83478744
4-[2-(azetidin-3-yl)-2-hydroxyethyl]phenol
CID 105447136
1-(3-ethylcyclohexyl)-2-(thian-4-yl)ethanol
CID 105104403

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-2-cyclobutylethanol?
The IUPAC name of 1-(azetidin-3-yl)-2-cyclobutylethanol (CID 105430410) is 1-(azetidin-3-yl)-2-cyclobutylethanol.
What is the SMILES notation for 1-(azetidin-3-yl)-2-cyclobutylethanol?
The canonical SMILES for 1-(azetidin-3-yl)-2-cyclobutylethanol is OC(CC1CCC1)C1CNC1.
What is the InChIKey of 1-(azetidin-3-yl)-2-cyclobutylethanol?
The InChIKey is FIXHXCXBYHFUDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c11-9(8-5-10-6-8)4-7-2-1-3-7/h7-11H,1-6H2.
What are the key properties of 1-(azetidin-3-yl)-2-cyclobutylethanol?
1-(azetidin-3-yl)-2-cyclobutylethanol has a molecular weight of 155.24 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-2-cyclobutylethanol is sourced from PubChem (CID 105430410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).