(1S)-1-fluoro-1-phenylnaphthalen-2-one

C16H11FO — CID 155930456

IUPAC(1S)-1-fluoro-1-phenylnaphthalen-2-one
SMILESO=C1C=Cc2ccccc2[C@@]1(F)c1ccccc1
InChIInChI=1S/C16H11FO/c17-16(13-7-2-1-3-8-13)14-9-5-4-6-12(14)10-11-15(16)18/h1-11H/t16-/m0/s1
InChIKeySUDRIOJHWRNBLE-INIZCTEOSA-N
MW238.26 g/mol
LogP3.50
Rot. Bonds1

About (1S)-1-fluoro-1-phenylnaphthalen-2-one

(1S)-1-fluoro-1-phenylnaphthalen-2-one (PubChem CID 155930456) has the molecular formula C16H11FO and a molecular weight of 238.26 g/mol. Its IUPAC name is (1S)-1-fluoro-1-phenylnaphthalen-2-one.

Molecular Properties

Compound Name(1S)-1-fluoro-1-phenylnaphthalen-2-one
PubChem CID155930456
Molecular FormulaC16H11FO
Molecular Weight238.26 g/mol
Exact Mass238.08
IUPAC Name(1S)-1-fluoro-1-phenylnaphthalen-2-one
SMILESO=C1C=Cc2ccccc2[C@@]1(F)c1ccccc1
InChIInChI=1S/C16H11FO/c17-16(13-7-2-1-3-8-13)14-9-5-4-6-12(14)10-11-15(16)18/h1-11H/t16-/m0/s1
InChIKeySUDRIOJHWRNBLE-INIZCTEOSA-N
XLogP3.50
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.26
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-fluoro-7-methoxy-1-phenylnaphthalen-2-one
CID 155930667
2-hydroxytricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene-2-carboxylic acid
CID 134096624
1-methyl-1-trimethylsilyloxynaphthalen-2-one
CID 10800462
[2-(hydroxymethyl)-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl]methanol
CID 18626557
3-methyl-2-phenylspiro[indene-1,1'-naphthalene]-2'-one
CID 132540245
3'-acetyl-3'-methylspiro[naphthalene-1,2'-oxirane]-2-one
CID 603721
1-phenyl-2H-naphthalene-1-carbaldehyde
CID 87494055
1-bromo-1-[(2-methylphenyl)methyl]naphthalen-2-one
CID 132549980
1-bromo-1-[(4-chlorophenyl)methyl]naphthalen-2-one
CID 132549977
2,3-diphenyl-6-(trifluoromethyl)spiro[indene-1,1'-naphthalene]-2'-one
CID 175186019
1-phenylisochromen-1-ol
CID 134891978
5-methoxy-3,3-dimethylspiro[2H-indene-1,1'-naphthalene]-2'-one
CID 138963859

Frequently Asked Questions

What is the IUPAC name of (1S)-1-fluoro-1-phenylnaphthalen-2-one?
The IUPAC name of (1S)-1-fluoro-1-phenylnaphthalen-2-one (CID 155930456) is (1S)-1-fluoro-1-phenylnaphthalen-2-one.
What is the SMILES notation for (1S)-1-fluoro-1-phenylnaphthalen-2-one?
The canonical SMILES for (1S)-1-fluoro-1-phenylnaphthalen-2-one is O=C1C=Cc2ccccc2[C@@]1(F)c1ccccc1.
What is the InChIKey of (1S)-1-fluoro-1-phenylnaphthalen-2-one?
The InChIKey is SUDRIOJHWRNBLE-INIZCTEOSA-N. The full InChI is InChI=1S/C16H11FO/c17-16(13-7-2-1-3-8-13)14-9-5-4-6-12(14)10-11-15(16)18/h1-11H/t16-/m0/s1.
What are the key properties of (1S)-1-fluoro-1-phenylnaphthalen-2-one?
(1S)-1-fluoro-1-phenylnaphthalen-2-one has a molecular weight of 238.26 g/mol, XLogP of 3.50, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-fluoro-1-phenylnaphthalen-2-one is sourced from PubChem (CID 155930456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).