2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide

C24H17FN6O — CID 46468871

IUPAC2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide
SMILESCc1nnnn1-c1cccc(NC(=O)c2cc(-c3ccc(F)cc3)nc3ccccc23)c1
InChIInChI=1S/C24H17FN6O/c1-15-28-29-30-31(15)19-6-4-5-18(13-19)26-24(32)21-14-23(16-9-11-17(25)12-10-16)27-22-8-3-2-7-20(21)22/h2-14H,1H3,(H,26,32)
InChIKeyUVAVZFUHUOYQQL-UHFFFAOYSA-N
MW424.44 g/mol
LogP4.58
Rot. Bonds4

About 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide

2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide (PubChem CID 46468871) has the molecular formula C24H17FN6O and a molecular weight of 424.44 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide
PubChem CID46468871
Molecular FormulaC24H17FN6O
Molecular Weight424.44 g/mol
Exact Mass424.14
IUPAC Name2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide
SMILESCc1nnnn1-c1cccc(NC(=O)c2cc(-c3ccc(F)cc3)nc3ccccc23)c1
InChIInChI=1S/C24H17FN6O/c1-15-28-29-30-31(15)19-6-4-5-18(13-19)26-24(32)21-14-23(16-9-11-17(25)12-10-16)27-22-8-3-2-7-20(21)22/h2-14H,1H3,(H,26,32)
InChIKeyUVAVZFUHUOYQQL-UHFFFAOYSA-N
XLogP4.58
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.44
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]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

1-ethyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55677068
2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 86983157
2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide
CID 18717027
2-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 18206028
N-(3,4-difluorophenyl)-2-(4-methylphenyl)quinoline-4-carboxamide
CID 1012287
N-(4-chlorophenyl)-2-(4-fluorophenyl)quinoline-4-carboxamide
CID 3131336
2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-4-phenylpyrimidine-5-carboxamide
CID 131889333
N-[3-(diethylsulfamoyl)phenyl]-2-(4-fluorophenyl)quinoline-4-carboxamide
CID 3627376
N-(3-fluorophenyl)-2-[1-(4-fluorophenyl)-5-methylpyrazol-4-yl]quinoline-4-carboxamide
CID 46323415
2-(4-fluorophenyl)-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxamide
CID 2439803
N-(4-acetamidophenyl)-2-(4-methylphenyl)quinoline-4-carboxamide
CID 4863526
N-(2-acetamido-1,3-benzothiazol-5-yl)-2-(4-fluorophenyl)quinoline-4-carboxamide
CID 46328665

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide?
The IUPAC name of 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide (CID 46468871) is 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide is Cc1nnnn1-c1cccc(NC(=O)c2cc(-c3ccc(F)cc3)nc3ccccc23)c1.
What is the InChIKey of 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide?
The InChIKey is UVAVZFUHUOYQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17FN6O/c1-15-28-29-30-31(15)19-6-4-5-18(13-19)26-24(32)21-14-23(16-9-11-17(25)12-10-16)27-22-8-3-2-7-20(21)22/h2-14H,1H3,(H,26,32).
What are the key properties of 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide?
2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide has a molecular weight of 424.44 g/mol, XLogP of 4.58, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]quinoline-4-carboxamide is sourced from PubChem (CID 46468871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).