1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol

C16H18O2 — CID 91658263

IUPAC1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol
SMILESCOc1ccc2cc(C(C)(O)C3CC3)ccc2c1
InChIInChI=1S/C16H18O2/c1-16(17,13-6-7-13)14-5-3-12-10-15(18-2)8-4-11(12)9-14/h3-5,8-10,13,17H,6-7H2,1-2H3
InChIKeyMKQLDNRYJFMYQL-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.47
Rot. Bonds3

About 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol

1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol (PubChem CID 91658263) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol
PubChem CID91658263
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol
SMILESCOc1ccc2cc(C(C)(O)C3CC3)ccc2c1
InChIInChI=1S/C16H18O2/c1-16(17,13-6-7-13)14-5-3-12-10-15(18-2)8-4-11(12)9-14/h3-5,8-10,13,17H,6-7H2,1-2H3
InChIKeyMKQLDNRYJFMYQL-UHFFFAOYSA-N
XLogP3.47
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[cyclopropyl(difluoro)methyl]-6-methoxynaphthalene
CID 116841772
2-tert-butyl-6-methoxynaphthalene;6-tert-butylnaphthalen-2-ol
CID 159191921
1-cyclopropyl-1-(4-propan-2-yloxyphenyl)ethanol
CID 62796946
1-cyclohexyl-1-(3,4-dimethoxyphenyl)ethanol
CID 114794874
1-(3-tert-butylphenyl)-1-cyclopropylethanol
CID 91657928
1-cyclopropyl-1-(3,4-difluorophenyl)ethanol
CID 62802186
cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol
CID 154301932
2-(6-methoxynaphthalen-2-yl)hexan-2-ol
CID 71294239
4-cyclopentyl-2-(4-methoxyphenyl)butan-2-ol
CID 114191696
1-(3-methoxyphenyl)-1-naphthalen-2-ylethanol
CID 62787792
(1S)-1-cyclopropyl-1-(3-methylphenyl)ethanol
CID 93311992
(5-methyl-2-propan-2-ylcyclohexyl) 2-hydroxy-2-(6-methoxynaphthalen-2-yl)propanoate
CID 84820404

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol?
The IUPAC name of 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol (CID 91658263) is 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol.
What is the SMILES notation for 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol?
The canonical SMILES for 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol is COc1ccc2cc(C(C)(O)C3CC3)ccc2c1.
What is the InChIKey of 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol?
The InChIKey is MKQLDNRYJFMYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-16(17,13-6-7-13)14-5-3-12-10-15(18-2)8-4-11(12)9-14/h3-5,8-10,13,17H,6-7H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol?
1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol has a molecular weight of 242.32 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(6-methoxynaphthalen-2-yl)ethanol is sourced from PubChem (CID 91658263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).