7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol

C15H16O2 — CID 105485591

IUPAC7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol
SMILESOCC1(c2ccc3cccc(O)c3c2)CCC1
InChIInChI=1S/C15H16O2/c16-10-15(7-2-8-15)12-6-5-11-3-1-4-14(17)13(11)9-12/h1,3-6,9,16-17H,2,7-8,10H2
InChIKeyGEKITHFWHNTLBB-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.96
Rot. Bonds2

About 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol

7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol (PubChem CID 105485591) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol.

Molecular Properties

Compound Name7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol
PubChem CID105485591
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol
SMILESOCC1(c2ccc3cccc(O)c3c2)CCC1
InChIInChI=1S/C15H16O2/c16-10-15(7-2-8-15)12-6-5-11-3-1-4-14(17)13(11)9-12/h1,3-6,9,16-17H,2,7-8,10H2
InChIKeyGEKITHFWHNTLBB-UHFFFAOYSA-N
XLogP2.96
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol?
The IUPAC name of 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol (CID 105485591) is 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol.
What is the SMILES notation for 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol?
The canonical SMILES for 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol is OCC1(c2ccc3cccc(O)c3c2)CCC1.
What is the InChIKey of 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol?
The InChIKey is GEKITHFWHNTLBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c16-10-15(7-2-8-15)12-6-5-11-3-1-4-14(17)13(11)9-12/h1,3-6,9,16-17H,2,7-8,10H2.
What are the key properties of 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol?
7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol has a molecular weight of 228.29 g/mol, XLogP of 2.96, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-(hydroxymethyl)cyclobutyl]naphthalen-1-ol is sourced from PubChem (CID 105485591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).