1-(1-adamantylmethyl)azetidin-3-ol

C14H23NO — CID 63282389

IUPAC1-(1-adamantylmethyl)azetidin-3-ol
SMILESOC1CN(CC23CC4CC(CC(C4)C2)C3)C1
InChIInChI=1S/C14H23NO/c16-13-7-15(8-13)9-14-4-10-1-11(5-14)3-12(2-10)6-14/h10-13,16H,1-9H2
InChIKeyNTJUPFUMIKRTMI-UHFFFAOYSA-N
MW221.34 g/mol
LogP1.88
Rot. Bonds2

About 1-(1-adamantylmethyl)azetidin-3-ol

1-(1-adamantylmethyl)azetidin-3-ol (PubChem CID 63282389) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 1-(1-adamantylmethyl)azetidin-3-ol.

Molecular Properties

Compound Name1-(1-adamantylmethyl)azetidin-3-ol
PubChem CID63282389
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name1-(1-adamantylmethyl)azetidin-3-ol
SMILESOC1CN(CC23CC4CC(CC(C4)C2)C3)C1
InChIInChI=1S/C14H23NO/c16-13-7-15(8-13)9-14-4-10-1-11(5-14)3-12(2-10)6-14/h10-13,16H,1-9H2
InChIKeyNTJUPFUMIKRTMI-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(1-adamantylmethyl)azetidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(1-adamantylmethyl)azetidin-3-ol?
The IUPAC name of 1-(1-adamantylmethyl)azetidin-3-ol (CID 63282389) is 1-(1-adamantylmethyl)azetidin-3-ol.
What is the SMILES notation for 1-(1-adamantylmethyl)azetidin-3-ol?
The canonical SMILES for 1-(1-adamantylmethyl)azetidin-3-ol is OC1CN(CC23CC4CC(CC(C4)C2)C3)C1.
What is the InChIKey of 1-(1-adamantylmethyl)azetidin-3-ol?
The InChIKey is NTJUPFUMIKRTMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c16-13-7-15(8-13)9-14-4-10-1-11(5-14)3-12(2-10)6-14/h10-13,16H,1-9H2.
What are the key properties of 1-(1-adamantylmethyl)azetidin-3-ol?
1-(1-adamantylmethyl)azetidin-3-ol has a molecular weight of 221.34 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-adamantylmethyl)azetidin-3-ol is sourced from PubChem (CID 63282389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).