3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol

C15H16O2 — CID 106823614

IUPAC3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol
SMILESCOC1CC(O)(c2ccc3ccccc3c2)C1
InChIInChI=1S/C15H16O2/c1-17-14-9-15(16,10-14)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,14,16H,9-10H2,1H3
InChIKeyQQMGPWUVWVLEEG-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.84
Rot. Bonds2

About 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol

3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol (PubChem CID 106823614) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol.

Molecular Properties

Compound Name3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol
PubChem CID106823614
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol
SMILESCOC1CC(O)(c2ccc3ccccc3c2)C1
InChIInChI=1S/C15H16O2/c1-17-14-9-15(16,10-14)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,14,16H,9-10H2,1H3
InChIKeyQQMGPWUVWVLEEG-UHFFFAOYSA-N
XLogP2.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol?
The IUPAC name of 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol (CID 106823614) is 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol.
What is the SMILES notation for 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol?
The canonical SMILES for 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol is COC1CC(O)(c2ccc3ccccc3c2)C1.
What is the InChIKey of 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol?
The InChIKey is QQMGPWUVWVLEEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c1-17-14-9-15(16,10-14)13-7-6-11-4-2-3-5-12(11)8-13/h2-8,14,16H,9-10H2,1H3.
What are the key properties of 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol?
3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol has a molecular weight of 228.29 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-naphthalen-2-ylcyclobutan-1-ol is sourced from PubChem (CID 106823614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).