3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol

C15H17NO — CID 80561260

IUPAC3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol
SMILESNC1CC(O)(Cc2cccc3ccccc23)C1
InChIInChI=1S/C15H17NO/c16-13-9-15(17,10-13)8-12-6-3-5-11-4-1-2-7-14(11)12/h1-7,13,17H,8-10,16H2
InChIKeyOJKWQQWVULSTQE-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.23
Rot. Bonds2

About 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol

3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol (PubChem CID 80561260) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol.

Molecular Properties

Compound Name3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol
PubChem CID80561260
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol
SMILESNC1CC(O)(Cc2cccc3ccccc23)C1
InChIInChI=1S/C15H17NO/c16-13-9-15(17,10-13)8-12-6-3-5-11-4-1-2-7-14(11)12/h1-7,13,17H,8-10,16H2
InChIKeyOJKWQQWVULSTQE-UHFFFAOYSA-N
XLogP2.23
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-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 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol?
The IUPAC name of 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol (CID 80561260) is 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol.
What is the SMILES notation for 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol?
The canonical SMILES for 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol is NC1CC(O)(Cc2cccc3ccccc23)C1.
What is the InChIKey of 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol?
The InChIKey is OJKWQQWVULSTQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c16-13-9-15(17,10-13)8-12-6-3-5-11-4-1-2-7-14(11)12/h1-7,13,17H,8-10,16H2.
What are the key properties of 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol?
3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol has a molecular weight of 227.31 g/mol, XLogP of 2.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(naphthalen-1-ylmethyl)cyclobutan-1-ol is sourced from PubChem (CID 80561260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).