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

C22H16FN3O2 — CID 51367754

IUPAC2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
SMILESCc1c(F)cccc1/N=c1\oc2ccccc2cc1C(=O)Nc1ccccn1
InChIInChI=1S/C22H16FN3O2/c1-14-17(23)8-6-9-18(14)25-22-16(13-15-7-2-3-10-19(15)28-22)21(27)26-20-11-4-5-12-24-20/h2-13H,1H3,(H,24,26,27)/b25-22-
InChIKeyYBQLKZWFLSVPJO-LVWGJNHUSA-N
MW373.39 g/mol
LogP4.76
Rot. Bonds3

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

2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide (PubChem CID 51367754) has the molecular formula C22H16FN3O2 and a molecular weight of 373.39 g/mol. Its IUPAC name is 2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide.

Molecular Properties

Compound Name2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
PubChem CID51367754
Molecular FormulaC22H16FN3O2
Molecular Weight373.39 g/mol
Exact Mass373.12
IUPAC Name2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
SMILESCc1c(F)cccc1/N=c1\oc2ccccc2cc1C(=O)Nc1ccccn1
InChIInChI=1S/C22H16FN3O2/c1-14-17(23)8-6-9-18(14)25-22-16(13-15-7-2-3-10-19(15)28-22)21(27)26-20-11-4-5-12-24-20/h2-13H,1H3,(H,24,26,27)/b25-22-
InChIKeyYBQLKZWFLSVPJO-LVWGJNHUSA-N
XLogP4.76
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.39
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367722
2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367726
2-(2-methoxyphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 53334824
2-(3-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367703
6-bromo-2-(2,3-dimethylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367429
2-(2-fluorophenyl)imino-8-methoxy-N-pyridin-2-ylchromene-3-carboxamide
CID 51367145
2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367847
2-(2-fluoro-4-methylphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367852
6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367462
methyl 4-[[3-(pyridin-2-ylcarbamoyl)chromen-2-ylidene]amino]benzoate
CID 51367720
N-(2,4-dimethylphenyl)-2-(2-fluorophenyl)iminochromene-3-carboxamide
CID 51367934
2-(2-chloro-4-methylphenyl)imino-7-hydroxy-N-pyridin-2-ylchromene-3-carboxamide
CID 135631517

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
The IUPAC name of 2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide (CID 51367754) is 2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide.
What is the SMILES notation for 2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
The canonical SMILES for 2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide is Cc1c(F)cccc1/N=c1\oc2ccccc2cc1C(=O)Nc1ccccn1.
What is the InChIKey of 2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
The InChIKey is YBQLKZWFLSVPJO-LVWGJNHUSA-N. The full InChI is InChI=1S/C22H16FN3O2/c1-14-17(23)8-6-9-18(14)25-22-16(13-15-7-2-3-10-19(15)28-22)21(27)26-20-11-4-5-12-24-20/h2-13H,1H3,(H,24,26,27)/b25-22-.
What are the key properties of 2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide has a molecular weight of 373.39 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide is sourced from PubChem (CID 51367754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).