(2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol

C18H19FO2 — CID 103395378

IUPAC(2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol
SMILESCOc1ccc(C(O)C2(c3ccccc3)CCC2)c(F)c1
InChIInChI=1S/C18H19FO2/c1-21-14-8-9-15(16(19)12-14)17(20)18(10-5-11-18)13-6-3-2-4-7-13/h2-4,6-9,12,17,20H,5,10-11H2,1H3
InChIKeyQNKJEHAJWKKCQA-UHFFFAOYSA-N
MW286.35 g/mol
LogP3.99
Rot. Bonds4

About (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol

(2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol (PubChem CID 103395378) has the molecular formula C18H19FO2 and a molecular weight of 286.35 g/mol. Its IUPAC name is (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol.

Molecular Properties

Compound Name(2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol
PubChem CID103395378
Molecular FormulaC18H19FO2
Molecular Weight286.35 g/mol
Exact Mass286.14
IUPAC Name(2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol
SMILESCOc1ccc(C(O)C2(c3ccccc3)CCC2)c(F)c1
InChIInChI=1S/C18H19FO2/c1-21-14-8-9-15(16(19)12-14)17(20)18(10-5-11-18)13-6-3-2-4-7-13/h2-4,6-9,12,17,20H,5,10-11H2,1H3
InChIKeyQNKJEHAJWKKCQA-UHFFFAOYSA-N
XLogP3.99
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-fluoro-4-methoxyphenyl)-(1-methoxycyclopentyl)methanol
CID 103395478
(5-fluoro-2-methoxyphenyl)-(1-phenylcyclopropyl)methanol
CID 62881250
bis(2-fluoro-4-methoxyphenyl)methanol
CID 102884350
(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanol
CID 55179614
2-(2-fluoro-4-methoxyphenyl)-2-hydroxyacetaldehyde
CID 103395038
(2-fluoro-4-methoxyphenyl)-phenylmethanamine
CID 43561220
(2-cyclopropylphenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 103395056
1-[1-bromo-2-(1-methoxycyclobutyl)ethyl]-2-fluoro-4-methoxybenzene
CID 103557775
[(2-fluoro-4-methoxyphenyl)-(1-methoxycyclobutyl)methyl]hydrazine
CID 103397668
1-(2-fluoro-4-methoxyphenyl)propane-1,2,3-triol
CID 170817736
1-[(2,5-dimethoxyphenyl)-hydroxymethyl]cyclopentan-1-ol
CID 103448378
(2-chloro-5-fluorophenyl)-(1-phenylcyclopropyl)methanol
CID 105394462

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol?
The IUPAC name of (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol (CID 103395378) is (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol.
What is the SMILES notation for (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol?
The canonical SMILES for (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol is COc1ccc(C(O)C2(c3ccccc3)CCC2)c(F)c1.
What is the InChIKey of (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol?
The InChIKey is QNKJEHAJWKKCQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FO2/c1-21-14-8-9-15(16(19)12-14)17(20)18(10-5-11-18)13-6-3-2-4-7-13/h2-4,6-9,12,17,20H,5,10-11H2,1H3.
What are the key properties of (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol?
(2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol has a molecular weight of 286.35 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4-methoxyphenyl)-(1-phenylcyclobutyl)methanol is sourced from PubChem (CID 103395378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).