2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene

C18H15FO — CID 132602819

IUPAC2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene
SMILESCOc1ccc(Cc2ccc3ccccc3c2)cc1F
InChIInChI=1S/C18H15FO/c1-20-18-9-7-14(12-17(18)19)10-13-6-8-15-4-2-3-5-16(15)11-13/h2-9,11-12H,10H2,1H3
InChIKeyRXLSRLQEWIHJOC-UHFFFAOYSA-N
MW266.31 g/mol
LogP4.58
Rot. Bonds3

About 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene

2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene (PubChem CID 132602819) has the molecular formula C18H15FO and a molecular weight of 266.31 g/mol. Its IUPAC name is 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene.

Molecular Properties

Compound Name2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene
PubChem CID132602819
Molecular FormulaC18H15FO
Molecular Weight266.31 g/mol
Exact Mass266.11
IUPAC Name2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene
SMILESCOc1ccc(Cc2ccc3ccccc3c2)cc1F
InChIInChI=1S/C18H15FO/c1-20-18-9-7-14(12-17(18)19)10-13-6-8-15-4-2-3-5-16(15)11-13/h2-9,11-12H,10H2,1H3
InChIKeyRXLSRLQEWIHJOC-UHFFFAOYSA-N
XLogP4.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-fluoro-1-methoxy-4-(phenoxymethyl)benzene
CID 60627904
2-(3-fluoro-4-methoxyphenyl)-N-(1-naphthalen-2-ylethyl)acetamide
CID 46599158
2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]quinoline
CID 112781074
2-methoxy-1,6-bis[(2-methoxynaphthalen-1-yl)methyl]naphthalene
CID 139095345
2-(3-fluoro-4-methoxyphenyl)acetaldehyde
CID 62796139
7,8-dimethoxy-1-(naphthalen-2-ylmethyl)isoquinoline
CID 11995264
2-(3-fluoro-4-methoxyphenyl)-1-(2-iodophenyl)ethanol
CID 115782342
2-(3-fluoro-4-methoxyphenyl)-1-(4-methoxyphenyl)ethanol
CID 62622685
2-fluoro-4-[(3-fluorophenoxy)methyl]-1-methoxybenzene
CID 60628032
2-[(3-benzylphenyl)methyl]naphthalene
CID 157208363
(3-fluoro-4-methoxyphenyl)methyl naphthalene-1-carboxylate
CID 7785264
1-(3-fluoro-4-methoxyphenyl)-N-methyl-3-phenylsulfanylpropan-2-amine
CID 65142128

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene?
The IUPAC name of 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene (CID 132602819) is 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene.
What is the SMILES notation for 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene?
The canonical SMILES for 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene is COc1ccc(Cc2ccc3ccccc3c2)cc1F.
What is the InChIKey of 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene?
The InChIKey is RXLSRLQEWIHJOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FO/c1-20-18-9-7-14(12-17(18)19)10-13-6-8-15-4-2-3-5-16(15)11-13/h2-9,11-12H,10H2,1H3.
What are the key properties of 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene?
2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene has a molecular weight of 266.31 g/mol, XLogP of 4.58, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoro-4-methoxyphenyl)methyl]naphthalene is sourced from PubChem (CID 132602819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).