6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one

C17H14FNO2 — CID 22641455

IUPAC6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one
SMILESCc1cc(=O)c2cc(F)c(OCc3ccccc3)cc2[nH]1
InChIInChI=1S/C17H14FNO2/c1-11-7-16(20)13-8-14(18)17(9-15(13)19-11)21-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,20)
InChIKeyJHKAPLOQRUDNCL-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.55
Rot. Bonds3

About 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one

6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one (PubChem CID 22641455) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one.

Molecular Properties

Compound Name6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one
PubChem CID22641455
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC Name6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one
SMILESCc1cc(=O)c2cc(F)c(OCc3ccccc3)cc2[nH]1
InChIInChI=1S/C17H14FNO2/c1-11-7-16(20)13-8-14(18)17(9-15(13)19-11)21-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,20)
InChIKeyJHKAPLOQRUDNCL-UHFFFAOYSA-N
XLogP3.55
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6,7-dimethoxy-2-methyl-1H-quinolin-4-one;hydrochloride
CID 91665124
4-chloro-6-fluoro-2-methyl-7-phenylmethoxyquinoline
CID 22641319
1-fluoro-4-methyl-5-nitro-2-phenylmethoxybenzene
CID 22414647
5-hydroxy-2-methyl-1H-pyridin-4-one;2-methyl-5-phenylmethoxy-1H-pyridin-4-one;hydrochloride
CID 161262115
6-methoxy-7-phenylmethoxy-1H-3,1-benzoxazine-2,4-dione
CID 11185633
5-(3-fluoro-4-phenylmethoxyphenyl)-1H-pyridin-2-one
CID 122200240
2-methyl-4-phenylmethoxy-1H-indole-7-carbonitrile
CID 174993082
5,13-dimethoxy-10-methyl-4,14-bis(phenylmethoxy)tricyclo[9.4.0.02,7]pentadeca-1(15),2,4,6,9,11,13-heptaen-8-one
CID 135025053
4-chloro-6-fluoro-7-phenylmethoxyquinazoline
CID 86605229
5-fluoro-2-methoxy-4-phenylmethoxybenzoic acid
CID 16754043
ethyl [3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-phenylmethoxy-1H-indol-2-yl] carbonate
CID 67622122
2-(2-fluoro-5-methylphenyl)-5-phenylmethoxy-1H-pyrimidin-6-one
CID 142874278

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one?
The IUPAC name of 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one (CID 22641455) is 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one.
What is the SMILES notation for 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one?
The canonical SMILES for 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one is Cc1cc(=O)c2cc(F)c(OCc3ccccc3)cc2[nH]1.
What is the InChIKey of 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one?
The InChIKey is JHKAPLOQRUDNCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c1-11-7-16(20)13-8-14(18)17(9-15(13)19-11)21-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,20).
What are the key properties of 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one?
6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one has a molecular weight of 283.30 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-methyl-7-phenylmethoxy-1H-quinolin-4-one is sourced from PubChem (CID 22641455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).