(3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol

C18H15FO2 — CID 61080907

IUPAC(3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol
SMILESCOc1ccc(C(O)c2cccc3ccccc23)cc1F
InChIInChI=1S/C18H15FO2/c1-21-17-10-9-13(11-16(17)19)18(20)15-8-4-6-12-5-2-3-7-14(12)15/h2-11,18,20H,1H3
InChIKeyJPCFHEWYRKYZCW-UHFFFAOYSA-N
MW282.31 g/mol
LogP4.07
Rot. Bonds3

About (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol

(3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol (PubChem CID 61080907) has the molecular formula C18H15FO2 and a molecular weight of 282.31 g/mol. Its IUPAC name is (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol.

Molecular Properties

Compound Name(3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol
PubChem CID61080907
Molecular FormulaC18H15FO2
Molecular Weight282.31 g/mol
Exact Mass282.11
IUPAC Name(3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol
SMILESCOc1ccc(C(O)c2cccc3ccccc23)cc1F
InChIInChI=1S/C18H15FO2/c1-21-17-10-9-13(11-16(17)19)18(20)15-8-4-6-12-5-2-3-7-14(12)15/h2-11,18,20H,1H3
InChIKeyJPCFHEWYRKYZCW-UHFFFAOYSA-N
XLogP4.07
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-fluoro-4-methoxyphenyl)-isoquinolin-8-ylmethanol
CID 103138898
(4-methoxy-3-nitrophenyl)-naphthalen-1-ylmethanol
CID 91678597
(S)-(4-chlorophenyl)-naphthalen-1-ylmethanol
CID 93489560
3-amino-1-(3-fluoro-4-methoxyphenyl)-2-(2-fluorophenyl)propan-1-ol
CID 65185510
methyl 4-[hydroxy(naphthalen-1-yl)methyl]benzoate
CID 46217309
1-[chloro-(4-fluoro-3-methoxyphenyl)methyl]naphthalene
CID 81289253
(3-fluoro-4-methoxyphenyl)-pyrimidin-2-ylmethanol
CID 62795072
(2,4-dichlorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 61083249
(4-bromo-2-fluorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 61082273
3-fluoro-N-[(2S)-2-hydroxy-2-naphthalen-1-ylethyl]-4-methoxybenzenesulfonamide
CID 95367229
(3-amino-4-fluorophenyl)-(2-methoxynaphthalen-1-yl)methanol
CID 118356144
(4-fluoro-3-methylphenyl)-(2-methoxyphenyl)methanol
CID 60929843

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol?
The IUPAC name of (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol (CID 61080907) is (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol.
What is the SMILES notation for (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol?
The canonical SMILES for (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol is COc1ccc(C(O)c2cccc3ccccc23)cc1F.
What is the InChIKey of (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol?
The InChIKey is JPCFHEWYRKYZCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FO2/c1-21-17-10-9-13(11-16(17)19)18(20)15-8-4-6-12-5-2-3-7-14(12)15/h2-11,18,20H,1H3.
What are the key properties of (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol?
(3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol has a molecular weight of 282.31 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-methoxyphenyl)-naphthalen-1-ylmethanol is sourced from PubChem (CID 61080907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).