6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide

C22H15BrFN3O2 — CID 51367462

IUPAC6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
SMILESCc1ccc(/N=c2\oc3ccc(Br)cc3cc2C(=O)Nc2ccccn2)c(F)c1
InChIInChI=1S/C22H15BrFN3O2/c1-13-5-7-18(17(24)10-13)26-22-16(21(28)27-20-4-2-3-9-25-20)12-14-11-15(23)6-8-19(14)29-22/h2-12H,1H3,(H,25,27,28)/b26-22-
InChIKeyJIRNNGFWSDSIQM-ROMGYVFFSA-N
MW452.28 g/mol
LogP5.52
Rot. Bonds3

About 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide

6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide (PubChem CID 51367462) has the molecular formula C22H15BrFN3O2 and a molecular weight of 452.28 g/mol. Its IUPAC name is 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide.

Molecular Properties

Compound Name6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
PubChem CID51367462
Molecular FormulaC22H15BrFN3O2
Molecular Weight452.28 g/mol
Exact Mass451.03
IUPAC Name6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
SMILESCc1ccc(/N=c2\oc3ccc(Br)cc3cc2C(=O)Nc2ccccn2)c(F)c1
InChIInChI=1S/C22H15BrFN3O2/c1-13-5-7-18(17(24)10-13)26-22-16(21(28)27-20-4-2-3-9-25-20)12-14-11-15(23)6-8-19(14)29-22/h2-12H,1H3,(H,25,27,28)/b26-22-
InChIKeyJIRNNGFWSDSIQM-ROMGYVFFSA-N
XLogP5.52
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.28
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-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-bromo-2-(2,3-dimethylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367429
2-(2-fluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367722
2-(2-fluoro-4-methylphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367852
6-bromo-2-(3-methoxyphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367432
2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367754
2-(2-chloro-4-methylphenyl)imino-7-hydroxy-N-pyridin-2-ylchromene-3-carboxamide
CID 135631517
2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367726
2-(2-fluoro-4-methylphenyl)imino-N-(1,3-thiazol-2-yl)chromene-3-carboxamide
CID 51367687
2-(3-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367703
2-(2-chloro-4-methylphenyl)imino-8-methoxy-N-pyridin-2-ylchromene-3-carboxamide
CID 51367169
N-acetyl-6-bromo-2-(2,4-difluorophenyl)iminochromene-3-carboxamide
CID 1223671
2-(2-fluorophenyl)imino-8-methoxy-N-pyridin-2-ylchromene-3-carboxamide
CID 51367145

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
The IUPAC name of 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide (CID 51367462) is 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide.
What is the SMILES notation for 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
The canonical SMILES for 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide is Cc1ccc(/N=c2\oc3ccc(Br)cc3cc2C(=O)Nc2ccccn2)c(F)c1.
What is the InChIKey of 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
The InChIKey is JIRNNGFWSDSIQM-ROMGYVFFSA-N. The full InChI is InChI=1S/C22H15BrFN3O2/c1-13-5-7-18(17(24)10-13)26-22-16(21(28)27-20-4-2-3-9-25-20)12-14-11-15(23)6-8-19(14)29-22/h2-12H,1H3,(H,25,27,28)/b26-22-.
What are the key properties of 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide has a molecular weight of 452.28 g/mol, XLogP of 5.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide is sourced from PubChem (CID 51367462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).