5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one

C10H7ClFNO — CID 107370193

IUPAC5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one
SMILESCc1cc(=O)c2c(Cl)cc(F)cc2[nH]1
InChIInChI=1S/C10H7ClFNO/c1-5-2-9(14)10-7(11)3-6(12)4-8(10)13-5/h2-4H,1H3,(H,13,14)
InChIKeyAGVFNKKVPRJZLD-UHFFFAOYSA-N
MW211.62 g/mol
LogP2.63
Rot. Bonds

About 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one

5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one (PubChem CID 107370193) has the molecular formula C10H7ClFNO and a molecular weight of 211.62 g/mol. Its IUPAC name is 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one.

Molecular Properties

Compound Name5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one
PubChem CID107370193
Molecular FormulaC10H7ClFNO
Molecular Weight211.62 g/mol
Exact Mass211.02
IUPAC Name5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one
SMILESCc1cc(=O)c2c(Cl)cc(F)cc2[nH]1
InChIInChI=1S/C10H7ClFNO/c1-5-2-9(14)10-7(11)3-6(12)4-8(10)13-5/h2-4H,1H3,(H,13,14)
InChIKeyAGVFNKKVPRJZLD-UHFFFAOYSA-N
XLogP2.63
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.62
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-chloro-3-ethyl-7-fluoro-2-methyl-1H-quinolin-4-one
CID 107370190
5-chloro-2-ethyl-7-fluoro-3-methyl-1H-quinolin-4-one
CID 107370200
5-chloro-4-(5,7-difluoro-4-oxo-1H-quinolin-2-yl)pyridine-2-carbonitrile
CID 167456031
5-chloro-7-fluoro-3-iodo-1H-quinolin-4-one
CID 107370154
2-(4-tert-butyl-2-methylphenyl)-7-fluoro-4-oxo-1H-quinoline-5-carbonitrile
CID 169256867
3-bromo-5-chloro-7-fluoro-1H-quinolin-4-one
CID 107370151
7-chloro-8-fluoro-2-methyl-1H-quinolin-4-one
CID 43667968
3-fluoro-2,6-dimethyl-1H-pyridin-4-one
CID 24971814
6-chloro-5-fluoro-2-methyl-1H-indole
CID 130063681
5,7-dichloro-6-fluoro-2-propan-2-yl-1H-quinolin-4-one
CID 107577447
4-chloro-3-(5,7-difluoro-6-methyl-4-oxo-1H-quinolin-2-yl)benzonitrile
CID 164916746
2-(2-chloro-5-iodo-3-pyridinyl)-5,7-difluoro-1H-quinolin-4-one
CID 167456017

Frequently Asked Questions

What is the IUPAC name of 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one?
The IUPAC name of 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one (CID 107370193) is 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one.
What is the SMILES notation for 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one?
The canonical SMILES for 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one is Cc1cc(=O)c2c(Cl)cc(F)cc2[nH]1.
What is the InChIKey of 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one?
The InChIKey is AGVFNKKVPRJZLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClFNO/c1-5-2-9(14)10-7(11)3-6(12)4-8(10)13-5/h2-4H,1H3,(H,13,14).
What are the key properties of 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one?
5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one has a molecular weight of 211.62 g/mol, XLogP of 2.63, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-7-fluoro-2-methyl-1H-quinolin-4-one is sourced from PubChem (CID 107370193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).