1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol

C18H20O2 — CID 79980257

IUPAC1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol
SMILESCOc1cccc(CC(O)c2ccc(C3CC3)cc2)c1
InChIInChI=1S/C18H20O2/c1-20-17-4-2-3-13(11-17)12-18(19)16-9-7-15(8-10-16)14-5-6-14/h2-4,7-11,14,18-19H,5-6,12H2,1H3
InChIKeyPGBRGFZXJSFDBM-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.85
Rot. Bonds5

About 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol

1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol (PubChem CID 79980257) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol
PubChem CID79980257
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol
SMILESCOc1cccc(CC(O)c2ccc(C3CC3)cc2)c1
InChIInChI=1S/C18H20O2/c1-20-17-4-2-3-13(11-17)12-18(19)16-9-7-15(8-10-16)14-5-6-14/h2-4,7-11,14,18-19H,5-6,12H2,1H3
InChIKeyPGBRGFZXJSFDBM-UHFFFAOYSA-N
XLogP3.85
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxy-3-methylphenyl)-2-(3-methoxyphenyl)ethanol
CID 61080511
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-methoxyphenyl)ethanol
CID 61087862
1-cyclobutyl-2-(3-methoxyphenyl)ethanol
CID 63017891
1-(4-chloro-3-methoxyphenyl)-2-(3-methoxyphenyl)ethanol
CID 79697442
1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanol
CID 60798818
1-(4-fluoro-3,5-dimethylphenyl)-2-(3-methoxyphenyl)ethanol
CID 65297136
4-cyclopropyl-N-[2-(3-methoxyphenyl)ethyl]aniline
CID 166807516
3-(3-methoxyphenyl)-1-(4-methoxyphenyl)propan-1-ol
CID 12648153
1-(3-cyclobutylphenyl)-2-(4-methoxyphenyl)ethanol
CID 114602177
1-cyclopropyl-3-methoxybenzene;methanol
CID 70274289
2-(3-bromophenyl)-1-(3-methoxyphenyl)ethanol
CID 60797863
2-(3-methoxyphenyl)-1-(3-methylcyclopentyl)ethanol
CID 65400147

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol?
The IUPAC name of 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol (CID 79980257) is 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol?
The canonical SMILES for 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol is COc1cccc(CC(O)c2ccc(C3CC3)cc2)c1.
What is the InChIKey of 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol?
The InChIKey is PGBRGFZXJSFDBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-20-17-4-2-3-13(11-17)12-18(19)16-9-7-15(8-10-16)14-5-6-14/h2-4,7-11,14,18-19H,5-6,12H2,1H3.
What are the key properties of 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol?
1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol has a molecular weight of 268.36 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopropylphenyl)-2-(3-methoxyphenyl)ethanol is sourced from PubChem (CID 79980257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).