6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide

C19H18FN3O3S — CID 108789667

IUPAC6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide
SMILESCc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c2cc(F)ccc2n1
InChIInChI=1S/C19H18FN3O3S/c1-12-10-17(16-11-14(20)4-7-18(16)23-12)19(24)22-9-8-13-2-5-15(6-3-13)27(21,25)26/h2-7,10-11H,8-9H2,1H3,(H,22,24)(H2,21,25,26)
InChIKeyDLINYEOXPDVZLM-UHFFFAOYSA-N
MW387.44 g/mol
LogP2.30
Rot. Bonds5

About 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide

6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide (PubChem CID 108789667) has the molecular formula C19H18FN3O3S and a molecular weight of 387.44 g/mol. Its IUPAC name is 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide.

Molecular Properties

Compound Name6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide
PubChem CID108789667
Molecular FormulaC19H18FN3O3S
Molecular Weight387.44 g/mol
Exact Mass387.11
IUPAC Name6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide
SMILESCc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c2cc(F)ccc2n1
InChIInChI=1S/C19H18FN3O3S/c1-12-10-17(16-11-14(20)4-7-18(16)23-12)19(24)22-9-8-13-2-5-15(6-3-13)27(21,25)26/h2-7,10-11H,8-9H2,1H3,(H,22,24)(H2,21,25,26)
InChIKeyDLINYEOXPDVZLM-UHFFFAOYSA-N
XLogP2.30
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-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

5-fluoro-3-methyl-N-[2-(4-sulfamoylphenyl)ethyl]-1-benzofuran-2-carboxamide
CID 9080530
5-(4-fluorophenyl)-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]-1H-pyrrole-3-carboxamide
CID 6623969
5-fluoro-2-pyrrol-1-yl-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 45493285
5-methyl-N-[2-(4-sulfamoylphenyl)ethyl]furo[3,2-b]pyridine-2-carboxamide
CID 16907015
6-fluoro-N-(2-hydroxypropyl)-2-methylquinoline-4-carboxamide
CID 110489253
6-fluoro-2-methyl-N-(2-piperidin-1-ylethyl)quinoline-4-carboxamide
CID 42750288
5,7-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 46585831
N-[2-(3,4-dimethoxyphenyl)ethyl]-7-fluoro-2-methylquinoline-4-carboxamide
CID 46422325
5-fluoro-N-[2-(4-sulfamoylphenyl)ethyl]-1-benzothiophene-2-carboxamide
CID 9402339
6-fluoro-N-[2-(4-sulfamoylphenyl)ethyl]-1-benzothiophene-2-carboxamide
CID 39965104
6-fluoro-4-methoxy-8-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-2-carboxamide
CID 71824060
4-methyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,3-thiazole-2-carboxamide
CID 110696130

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide?
The IUPAC name of 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide (CID 108789667) is 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide.
What is the SMILES notation for 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide?
The canonical SMILES for 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide is Cc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c2cc(F)ccc2n1.
What is the InChIKey of 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide?
The InChIKey is DLINYEOXPDVZLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O3S/c1-12-10-17(16-11-14(20)4-7-18(16)23-12)19(24)22-9-8-13-2-5-15(6-3-13)27(21,25)26/h2-7,10-11H,8-9H2,1H3,(H,22,24)(H2,21,25,26).
What are the key properties of 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide?
6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide has a molecular weight of 387.44 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-methyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide is sourced from PubChem (CID 108789667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).