1-(4-methylcyclohexyl)azetidin-3-ol

C10H19NO — CID 64775696

IUPAC1-(4-methylcyclohexyl)azetidin-3-ol
SMILESCC1CCC(N2CC(O)C2)CC1
InChIInChI=1S/C10H19NO/c1-8-2-4-9(5-3-8)11-6-10(12)7-11/h8-10,12H,2-7H2,1H3
InChIKeySBVRXQYINMQJIR-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.24
Rot. Bonds1

About 1-(4-methylcyclohexyl)azetidin-3-ol

1-(4-methylcyclohexyl)azetidin-3-ol (PubChem CID 64775696) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-(4-methylcyclohexyl)azetidin-3-ol.

Molecular Properties

Compound Name1-(4-methylcyclohexyl)azetidin-3-ol
PubChem CID64775696
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-(4-methylcyclohexyl)azetidin-3-ol
SMILESCC1CCC(N2CC(O)C2)CC1
InChIInChI=1S/C10H19NO/c1-8-2-4-9(5-3-8)11-6-10(12)7-11/h8-10,12H,2-7H2,1H3
InChIKeySBVRXQYINMQJIR-UHFFFAOYSA-N
XLogP1.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
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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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylcyclohexyl)azetidin-3-ol?
The IUPAC name of 1-(4-methylcyclohexyl)azetidin-3-ol (CID 64775696) is 1-(4-methylcyclohexyl)azetidin-3-ol.
What is the SMILES notation for 1-(4-methylcyclohexyl)azetidin-3-ol?
The canonical SMILES for 1-(4-methylcyclohexyl)azetidin-3-ol is CC1CCC(N2CC(O)C2)CC1.
What is the InChIKey of 1-(4-methylcyclohexyl)azetidin-3-ol?
The InChIKey is SBVRXQYINMQJIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-8-2-4-9(5-3-8)11-6-10(12)7-11/h8-10,12H,2-7H2,1H3.
What are the key properties of 1-(4-methylcyclohexyl)azetidin-3-ol?
1-(4-methylcyclohexyl)azetidin-3-ol has a molecular weight of 169.27 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylcyclohexyl)azetidin-3-ol is sourced from PubChem (CID 64775696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).