(3-cyclobutylphenyl)-(4-methoxyphenyl)methanol

C18H20O2 — CID 114601153

IUPAC(3-cyclobutylphenyl)-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2cccc(C3CCC3)c2)cc1
InChIInChI=1S/C18H20O2/c1-20-17-10-8-14(9-11-17)18(19)16-7-3-6-15(12-16)13-4-2-5-13/h3,6-13,18-19H,2,4-5H2,1H3
InChIKeyZINKDJIKWOBUIO-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.04
Rot. Bonds4

About (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol

(3-cyclobutylphenyl)-(4-methoxyphenyl)methanol (PubChem CID 114601153) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol.

Molecular Properties

Compound Name(3-cyclobutylphenyl)-(4-methoxyphenyl)methanol
PubChem CID114601153
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name(3-cyclobutylphenyl)-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2cccc(C3CCC3)c2)cc1
InChIInChI=1S/C18H20O2/c1-20-17-10-8-14(9-11-17)18(19)16-7-3-6-15(12-16)13-4-2-5-13/h3,6-13,18-19H,2,4-5H2,1H3
InChIKeyZINKDJIKWOBUIO-UHFFFAOYSA-N
XLogP4.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-cyclobutylphenyl)-(4-methoxyphenyl)methanamine
CID 114602513
1-(3-cyclobutylphenyl)-2-(4-methoxyphenyl)ethanol
CID 114602177
(3-cyclopropylphenyl)-(3,4-dimethoxyphenyl)methanol
CID 79973193
[3-(1,3-dioxolan-2-yl)phenyl]-(4-methoxyphenyl)methanol
CID 54520451
(5-chloro-2-methoxyphenyl)-(3-cyclobutylphenyl)methanol
CID 115839083
(4-chlorophenyl)-(3-cyclopropylphenyl)methanol
CID 79979843
(3-cyclopropyloxyphenyl)-(3-cyclopropylphenyl)methanol
CID 114520953
(3-cyclobutylphenyl)-(3,5-dimethyl-2-pyridinyl)methanol
CID 114602448
3-[(3-cyclobutylphenyl)-hydroxymethyl]benzonitrile
CID 114601548
(S)-(3-bromophenyl)-(4-methoxyphenyl)methanol
CID 93325981
(S)-(3-fluorophenyl)-(4-methoxyphenyl)methanol
CID 7154378
(3-cyclobutylphenyl)-(2,5-dimethylfuran-3-yl)methanol
CID 115838981

Frequently Asked Questions

What is the IUPAC name of (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol?
The IUPAC name of (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol (CID 114601153) is (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol.
What is the SMILES notation for (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol?
The canonical SMILES for (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol is COc1ccc(C(O)c2cccc(C3CCC3)c2)cc1.
What is the InChIKey of (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol?
The InChIKey is ZINKDJIKWOBUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-20-17-10-8-14(9-11-17)18(19)16-7-3-6-15(12-16)13-4-2-5-13/h3,6-13,18-19H,2,4-5H2,1H3.
What are the key properties of (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol?
(3-cyclobutylphenyl)-(4-methoxyphenyl)methanol has a molecular weight of 268.36 g/mol, XLogP of 4.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclobutylphenyl)-(4-methoxyphenyl)methanol is sourced from PubChem (CID 114601153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).