2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide

C21H13F2N3O2 — CID 51367726

IUPAC2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
SMILESO=C(Nc1ccccn1)c1cc2ccccc2o/c1=N\c1cc(F)ccc1F
InChIInChI=1S/C21H13F2N3O2/c22-14-8-9-16(23)17(12-14)25-21-15(11-13-5-1-2-6-18(13)28-21)20(27)26-19-7-3-4-10-24-19/h1-12H,(H,24,26,27)/b25-21-
InChIKeySPTZZIQECCEYRX-DAFNUICNSA-N
MW377.35 g/mol
LogP4.59
Rot. Bonds3

About 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide

2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide (PubChem CID 51367726) has the molecular formula C21H13F2N3O2 and a molecular weight of 377.35 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
PubChem CID51367726
Molecular FormulaC21H13F2N3O2
Molecular Weight377.35 g/mol
Exact Mass377.10
IUPAC Name2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
SMILESO=C(Nc1ccccn1)c1cc2ccccc2o/c1=N\c1cc(F)ccc1F
InChIInChI=1S/C21H13F2N3O2/c22-14-8-9-16(23)17(12-14)25-21-15(11-13-5-1-2-6-18(13)28-21)20(27)26-19-7-3-4-10-24-19/h1-12H,(H,24,26,27)/b25-21-
InChIKeySPTZZIQECCEYRX-DAFNUICNSA-N
XLogP4.59
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.35
LogP ≤ 54.59
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-(3-fluoro-2-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367754
2-(2-methoxyphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 53334824
2-(3-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367703
methyl 4-[[3-(pyridin-2-ylcarbamoyl)chromen-2-ylidene]amino]benzoate
CID 51367720
2-(5-chloro-2-fluorophenyl)imino-N-(1,3-thiazol-2-yl)chromene-3-carboxamide
CID 51367701
2-(2-fluorophenyl)imino-8-methoxy-N-pyridin-2-ylchromene-3-carboxamide
CID 51367145
6-bromo-2-(2-fluoro-4-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367462
2-(2-chloro-4-fluorophenyl)imino-8-methoxy-N-pyridin-2-ylchromene-3-carboxamide
CID 51367154
2-(2-fluoro-4-methylphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367852
2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367847
6-bromo-2-(2,3-dimethylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367429

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
The IUPAC name of 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide (CID 51367726) is 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide.
What is the SMILES notation for 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
The canonical SMILES for 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide is O=C(Nc1ccccn1)c1cc2ccccc2o/c1=N\c1cc(F)ccc1F.
What is the InChIKey of 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
The InChIKey is SPTZZIQECCEYRX-DAFNUICNSA-N. The full InChI is InChI=1S/C21H13F2N3O2/c22-14-8-9-16(23)17(12-14)25-21-15(11-13-5-1-2-6-18(13)28-21)20(27)26-19-7-3-4-10-24-19/h1-12H,(H,24,26,27)/b25-21-.
What are the key properties of 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide?
2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide has a molecular weight of 377.35 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)imino-N-pyridin-2-ylchromene-3-carboxamide is sourced from PubChem (CID 51367726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).