2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide

C22H15ClFN3O2 — CID 51367847

IUPAC2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
SMILESCc1cccc(NC(=O)c2cc3ccccc3o/c2=N\c2cccc(Cl)c2F)n1
InChIInChI=1S/C22H15ClFN3O2/c1-13-6-4-11-19(25-13)27-21(28)15-12-14-7-2-3-10-18(14)29-22(15)26-17-9-5-8-16(23)20(17)24/h2-12H,1H3,(H,25,27,28)/b26-22-
InChIKeyAEFRQZOAQNLGIX-ROMGYVFFSA-N
MW407.83 g/mol
LogP5.41
Rot. Bonds3

About 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide

2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide (PubChem CID 51367847) has the molecular formula C22H15ClFN3O2 and a molecular weight of 407.83 g/mol. Its IUPAC name is 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide.

Molecular Properties

Compound Name2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
PubChem CID51367847
Molecular FormulaC22H15ClFN3O2
Molecular Weight407.83 g/mol
Exact Mass407.08
IUPAC Name2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
SMILESCc1cccc(NC(=O)c2cc3ccccc3o/c2=N\c2cccc(Cl)c2F)n1
InChIInChI=1S/C22H15ClFN3O2/c1-13-6-4-11-19(25-13)27-21(28)15-12-14-7-2-3-10-18(14)29-22(15)26-17-9-5-8-16(23)20(17)24/h2-12H,1H3,(H,25,27,28)/b26-22-
InChIKeyAEFRQZOAQNLGIX-ROMGYVFFSA-N
XLogP5.41
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.83
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-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

2-(2-fluoro-4-methylphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367852
2-(3-chlorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367843
2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367754
2-(3-chloro-4-methoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367859
2-(4-methoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51370455
2-(2-chlorophenyl)imino-N-(2-methylphenyl)chromene-3-carboxamide
CID 51367890
2-(3-methoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367823
2-(2-fluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367722
2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367828
N-(4-chlorophenyl)-2-(2-methylphenyl)iminochromene-3-carboxamide
CID 51370435
2-(4-chlorophenyl)imino-7-hydroxy-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 135631616
2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367726

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide?
The IUPAC name of 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide (CID 51367847) is 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide.
What is the SMILES notation for 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide?
The canonical SMILES for 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide is Cc1cccc(NC(=O)c2cc3ccccc3o/c2=N\c2cccc(Cl)c2F)n1.
What is the InChIKey of 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide?
The InChIKey is AEFRQZOAQNLGIX-ROMGYVFFSA-N. The full InChI is InChI=1S/C22H15ClFN3O2/c1-13-6-4-11-19(25-13)27-21(28)15-12-14-7-2-3-10-18(14)29-22(15)26-17-9-5-8-16(23)20(17)24/h2-12H,1H3,(H,25,27,28)/b26-22-.
What are the key properties of 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide?
2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide has a molecular weight of 407.83 g/mol, XLogP of 5.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide is sourced from PubChem (CID 51367847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).