4-[(4-fluorophenyl)methyl]naphthalen-1-ol

C17H13FO — CID 70607159

IUPAC4-[(4-fluorophenyl)methyl]naphthalen-1-ol
SMILESOc1ccc(Cc2ccc(F)cc2)c2ccccc12
InChIInChI=1S/C17H13FO/c18-14-8-5-12(6-9-14)11-13-7-10-17(19)16-4-2-1-3-15(13)16/h1-10,19H,11H2
InChIKeyNNXJSEVURMRVMU-UHFFFAOYSA-N
MW252.29 g/mol
LogP4.28
Rot. Bonds2

About 4-[(4-fluorophenyl)methyl]naphthalen-1-ol

4-[(4-fluorophenyl)methyl]naphthalen-1-ol (PubChem CID 70607159) has the molecular formula C17H13FO and a molecular weight of 252.29 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methyl]naphthalen-1-ol.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methyl]naphthalen-1-ol
PubChem CID70607159
Molecular FormulaC17H13FO
Molecular Weight252.29 g/mol
Exact Mass252.10
IUPAC Name4-[(4-fluorophenyl)methyl]naphthalen-1-ol
SMILESOc1ccc(Cc2ccc(F)cc2)c2ccccc12
InChIInChI=1S/C17H13FO/c18-14-8-5-12(6-9-14)11-13-7-10-17(19)16-4-2-1-3-15(13)16/h1-10,19H,11H2
InChIKeyNNXJSEVURMRVMU-UHFFFAOYSA-N
XLogP4.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(4-fluorophenyl)methyl]naphthalene
CID 11118033
4-[(4-fluorophenyl)methyl]benzene-1,3-diol
CID 164899043
4-[(5-hydroxynaphthalen-1-yl)methyl]benzaldehyde
CID 88594640
4-[(4-hydroxyphenyl)methyl]naphthalene-1,8-diol
CID 129291927
4-[(fluoroamino)methyl]naphthalen-1-ol
CID 143092514
4-bromo-2-[(4-fluorophenyl)methyl]phenol
CID 68530716
4-[(2,6-dimethylphenyl)methyl]-2-[(4-fluorophenyl)methyl]phenol
CID 141114288
2-fluoro-4-[(4-fluorophenyl)methyl]phenol
CID 151291019
4-(2,6-dimethylphenoxy)-2-[(4-fluorophenyl)methyl]phenol
CID 141126761
bis(4-fluorophenyl)-(4-hydroxynaphthalen-1-yl)sulfanium
CID 145450937
4-(cyclopropylmethyl)naphthalen-1-ol
CID 70606669
4-[2-(4-fluorophenyl)ethyl]benzene-1,2,3-triol
CID 46195675

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methyl]naphthalen-1-ol?
The IUPAC name of 4-[(4-fluorophenyl)methyl]naphthalen-1-ol (CID 70607159) is 4-[(4-fluorophenyl)methyl]naphthalen-1-ol.
What is the SMILES notation for 4-[(4-fluorophenyl)methyl]naphthalen-1-ol?
The canonical SMILES for 4-[(4-fluorophenyl)methyl]naphthalen-1-ol is Oc1ccc(Cc2ccc(F)cc2)c2ccccc12.
What is the InChIKey of 4-[(4-fluorophenyl)methyl]naphthalen-1-ol?
The InChIKey is NNXJSEVURMRVMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FO/c18-14-8-5-12(6-9-14)11-13-7-10-17(19)16-4-2-1-3-15(13)16/h1-10,19H,11H2.
What are the key properties of 4-[(4-fluorophenyl)methyl]naphthalen-1-ol?
4-[(4-fluorophenyl)methyl]naphthalen-1-ol has a molecular weight of 252.29 g/mol, XLogP of 4.28, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)methyl]naphthalen-1-ol is sourced from PubChem (CID 70607159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).