[1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol

C16H18O — CID 105484041

IUPAC[1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol
SMILESCc1cccc2ccc(C3(CO)CCC3)cc12
InChIInChI=1S/C16H18O/c1-12-4-2-5-13-6-7-14(10-15(12)13)16(11-17)8-3-9-16/h2,4-7,10,17H,3,8-9,11H2,1H3
InChIKeyHQXODOVPGSWYJY-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.56
Rot. Bonds2

About [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol

[1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol (PubChem CID 105484041) has the molecular formula C16H18O and a molecular weight of 226.32 g/mol. Its IUPAC name is [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol.

Molecular Properties

Compound Name[1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol
PubChem CID105484041
Molecular FormulaC16H18O
Molecular Weight226.32 g/mol
Exact Mass226.14
IUPAC Name[1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol
SMILESCc1cccc2ccc(C3(CO)CCC3)cc12
InChIInChI=1S/C16H18O/c1-12-4-2-5-13-6-7-14(10-15(12)13)16(11-17)8-3-9-16/h2,4-7,10,17H,3,8-9,11H2,1H3
InChIKeyHQXODOVPGSWYJY-UHFFFAOYSA-N
XLogP3.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol?
The IUPAC name of [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol (CID 105484041) is [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol.
What is the SMILES notation for [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol?
The canonical SMILES for [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol is Cc1cccc2ccc(C3(CO)CCC3)cc12.
What is the InChIKey of [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol?
The InChIKey is HQXODOVPGSWYJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O/c1-12-4-2-5-13-6-7-14(10-15(12)13)16(11-17)8-3-9-16/h2,4-7,10,17H,3,8-9,11H2,1H3.
What are the key properties of [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol?
[1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol has a molecular weight of 226.32 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(8-methylnaphthalen-2-yl)cyclobutyl]methanol is sourced from PubChem (CID 105484041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).