6-fluoro-N-methyl-4-oxochromene-2-carboxamide

C11H8FNO3 — CID 139338161

IUPAC6-fluoro-N-methyl-4-oxochromene-2-carboxamide
SMILESCNC(=O)c1cc(=O)c2cc(F)ccc2o1
InChIInChI=1S/C11H8FNO3/c1-13-11(15)10-5-8(14)7-4-6(12)2-3-9(7)16-10/h2-5H,1H3,(H,13,15)
InChIKeySFVJBKLIRVQQHB-UHFFFAOYSA-N
MW221.19 g/mol
LogP1.29
Rot. Bonds1

About 6-fluoro-N-methyl-4-oxochromene-2-carboxamide

6-fluoro-N-methyl-4-oxochromene-2-carboxamide (PubChem CID 139338161) has the molecular formula C11H8FNO3 and a molecular weight of 221.19 g/mol. Its IUPAC name is 6-fluoro-N-methyl-4-oxochromene-2-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-methyl-4-oxochromene-2-carboxamide
PubChem CID139338161
Molecular FormulaC11H8FNO3
Molecular Weight221.19 g/mol
Exact Mass221.05
IUPAC Name6-fluoro-N-methyl-4-oxochromene-2-carboxamide
SMILESCNC(=O)c1cc(=O)c2cc(F)ccc2o1
InChIInChI=1S/C11H8FNO3/c1-13-11(15)10-5-8(14)7-4-6(12)2-3-9(7)16-10/h2-5H,1H3,(H,13,15)
InChIKeySFVJBKLIRVQQHB-UHFFFAOYSA-N
XLogP1.29
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.19
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-fluoro-N-methyl-4-oxochromene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-fluoro-4-oxochromene-2-carboxylate
CID 6951269
6-chloro-N-(4-fluorophenyl)-4-oxochromene-2-carboxamide
CID 9040132
N-[(1-acetamidocyclohexyl)methyl]-6-fluoro-4-oxochromene-2-carboxamide
CID 139328028
N-(5-fluoro-2-methylphenyl)-4-oxochromene-2-carboxamide
CID 9097785
tert-butyl 4-[(6-fluoro-4-oxochromene-2-carbonyl)amino]piperidine-1-carboxylate
CID 11974459
2-[3-(3,3-difluorocyclobutyl)propanoyl]-6-fluorochromen-4-one
CID 161419791
6-fluoro-2-(hydroxymethyl)chromen-4-one
CID 14089208
N-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-6-fluoro-4-oxochromene-2-carboxamide
CID 154860909
N-[3-(4-fluorophenyl)prop-2-ynyl]-4-oxochromene-2-carboxamide
CID 90548226
N-[[4-[3-[benzyl(methyl)amino]propanoylamino]phenyl]methyl]-6-fluoro-4-oxochromene-2-carboxamide
CID 167875054
N-(cyclohexylmethyl)-7-fluoro-4-oxochromene-2-carboxamide
CID 86227185
N-[3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propyl]-6-fluoro-4-oxochromene-2-carboxamide
CID 166185491

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-methyl-4-oxochromene-2-carboxamide?
The IUPAC name of 6-fluoro-N-methyl-4-oxochromene-2-carboxamide (CID 139338161) is 6-fluoro-N-methyl-4-oxochromene-2-carboxamide.
What is the SMILES notation for 6-fluoro-N-methyl-4-oxochromene-2-carboxamide?
The canonical SMILES for 6-fluoro-N-methyl-4-oxochromene-2-carboxamide is CNC(=O)c1cc(=O)c2cc(F)ccc2o1.
What is the InChIKey of 6-fluoro-N-methyl-4-oxochromene-2-carboxamide?
The InChIKey is SFVJBKLIRVQQHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FNO3/c1-13-11(15)10-5-8(14)7-4-6(12)2-3-9(7)16-10/h2-5H,1H3,(H,13,15).
What are the key properties of 6-fluoro-N-methyl-4-oxochromene-2-carboxamide?
6-fluoro-N-methyl-4-oxochromene-2-carboxamide has a molecular weight of 221.19 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-methyl-4-oxochromene-2-carboxamide is sourced from PubChem (CID 139338161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).