2-(6-methoxynaphthalen-2-yl)hexan-2-ol

C17H22O2 — CID 71294239

IUPAC2-(6-methoxynaphthalen-2-yl)hexan-2-ol
SMILESCCCCC(C)(O)c1ccc2cc(OC)ccc2c1
InChIInChI=1S/C17H22O2/c1-4-5-10-17(2,18)15-8-6-14-12-16(19-3)9-7-13(14)11-15/h6-9,11-12,18H,4-5,10H2,1-3H3
InChIKeyQVDUBYQEHKWPLD-UHFFFAOYSA-N
MW258.36 g/mol
LogP4.25
Rot. Bonds5

About 2-(6-methoxynaphthalen-2-yl)hexan-2-ol

2-(6-methoxynaphthalen-2-yl)hexan-2-ol (PubChem CID 71294239) has the molecular formula C17H22O2 and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-(6-methoxynaphthalen-2-yl)hexan-2-ol.

Molecular Properties

Compound Name2-(6-methoxynaphthalen-2-yl)hexan-2-ol
PubChem CID71294239
Molecular FormulaC17H22O2
Molecular Weight258.36 g/mol
Exact Mass258.16
IUPAC Name2-(6-methoxynaphthalen-2-yl)hexan-2-ol
SMILESCCCCC(C)(O)c1ccc2cc(OC)ccc2c1
InChIInChI=1S/C17H22O2/c1-4-5-10-17(2,18)15-8-6-14-12-16(19-3)9-7-13(14)11-15/h6-9,11-12,18H,4-5,10H2,1-3H3
InChIKeyQVDUBYQEHKWPLD-UHFFFAOYSA-N
XLogP4.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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1-(6-methoxynaphthalen-2-yl)-3-methylnon-1-yn-3-ol
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CID 91658263
2-(4-methoxyphenyl)pentan-2-amine
CID 43810210
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CID 66002453
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CID 62621826

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxynaphthalen-2-yl)hexan-2-ol?
The IUPAC name of 2-(6-methoxynaphthalen-2-yl)hexan-2-ol (CID 71294239) is 2-(6-methoxynaphthalen-2-yl)hexan-2-ol.
What is the SMILES notation for 2-(6-methoxynaphthalen-2-yl)hexan-2-ol?
The canonical SMILES for 2-(6-methoxynaphthalen-2-yl)hexan-2-ol is CCCCC(C)(O)c1ccc2cc(OC)ccc2c1.
What is the InChIKey of 2-(6-methoxynaphthalen-2-yl)hexan-2-ol?
The InChIKey is QVDUBYQEHKWPLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22O2/c1-4-5-10-17(2,18)15-8-6-14-12-16(19-3)9-7-13(14)11-15/h6-9,11-12,18H,4-5,10H2,1-3H3.
What are the key properties of 2-(6-methoxynaphthalen-2-yl)hexan-2-ol?
2-(6-methoxynaphthalen-2-yl)hexan-2-ol has a molecular weight of 258.36 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxynaphthalen-2-yl)hexan-2-ol is sourced from PubChem (CID 71294239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).