(2,4-difluorophenyl)-naphthalen-1-ylmethanol

C17H12F2O — CID 61087726

IUPAC(2,4-difluorophenyl)-naphthalen-1-ylmethanol
SMILESOC(c1ccc(F)cc1F)c1cccc2ccccc12
InChIInChI=1S/C17H12F2O/c18-12-8-9-15(16(19)10-12)17(20)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,17,20H
InChIKeySELVOIIKUQESST-UHFFFAOYSA-N
MW270.28 g/mol
LogP4.20
Rot. Bonds2

About (2,4-difluorophenyl)-naphthalen-1-ylmethanol

(2,4-difluorophenyl)-naphthalen-1-ylmethanol (PubChem CID 61087726) has the molecular formula C17H12F2O and a molecular weight of 270.28 g/mol. Its IUPAC name is (2,4-difluorophenyl)-naphthalen-1-ylmethanol.

Molecular Properties

Compound Name(2,4-difluorophenyl)-naphthalen-1-ylmethanol
PubChem CID61087726
Molecular FormulaC17H12F2O
Molecular Weight270.28 g/mol
Exact Mass270.09
IUPAC Name(2,4-difluorophenyl)-naphthalen-1-ylmethanol
SMILESOC(c1ccc(F)cc1F)c1cccc2ccccc12
InChIInChI=1S/C17H12F2O/c18-12-8-9-15(16(19)10-12)17(20)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,17,20H
InChIKeySELVOIIKUQESST-UHFFFAOYSA-N
XLogP4.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(5-fluoro-2-methylphenyl)-naphthalen-1-ylmethanol
CID 62791504
(2-aminophenyl)-(2,4-difluorophenyl)methanol
CID 64833381
1-benzothiophen-7-yl-(2,4-difluorophenyl)methanol
CID 81141862
2-(2,5-difluorophenyl)-1-naphthalen-1-ylethanol
CID 62716051
(5-bromo-2-fluorophenyl)-naphthalen-1-ylmethanol
CID 63894699
(2,4-difluorophenyl)-naphthalen-2-ylmethanol
CID 61087912
(S)-(2-chlorophenyl)-naphthalen-1-ylmethanol
CID 92533915
(S)-(2-bromophenyl)-naphthalen-1-ylmethanol
CID 94601935
(1S,2S)-1,2-dinaphthalen-1-ylethane-1,2-diol
CID 10470897
(4-chloro-2-fluorophenyl)-isoquinolin-5-ylmethanol
CID 63082098
(4-fluoro-1-methylpyrrol-2-yl)-naphthalen-1-ylmethanol
CID 121226334
2-(2-chloro-5-fluorophenyl)-1-naphthalen-1-ylethanol
CID 102617231

Frequently Asked Questions

What is the IUPAC name of (2,4-difluorophenyl)-naphthalen-1-ylmethanol?
The IUPAC name of (2,4-difluorophenyl)-naphthalen-1-ylmethanol (CID 61087726) is (2,4-difluorophenyl)-naphthalen-1-ylmethanol.
What is the SMILES notation for (2,4-difluorophenyl)-naphthalen-1-ylmethanol?
The canonical SMILES for (2,4-difluorophenyl)-naphthalen-1-ylmethanol is OC(c1ccc(F)cc1F)c1cccc2ccccc12.
What is the InChIKey of (2,4-difluorophenyl)-naphthalen-1-ylmethanol?
The InChIKey is SELVOIIKUQESST-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12F2O/c18-12-8-9-15(16(19)10-12)17(20)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,17,20H.
What are the key properties of (2,4-difluorophenyl)-naphthalen-1-ylmethanol?
(2,4-difluorophenyl)-naphthalen-1-ylmethanol has a molecular weight of 270.28 g/mol, XLogP of 4.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-difluorophenyl)-naphthalen-1-ylmethanol is sourced from PubChem (CID 61087726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).