2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide

C23H17ClN2O2 — CID 53334867

IUPAC2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide
SMILESCc1ccc(Cl)cc1/N=c1\oc2ccccc2cc1C(=O)Nc1ccccc1
InChIInChI=1S/C23H17ClN2O2/c1-15-11-12-17(24)14-20(15)26-23-19(13-16-7-5-6-10-21(16)28-23)22(27)25-18-8-3-2-4-9-18/h2-14H,1H3,(H,25,27)/b26-23-
InChIKeyALHXAWHKKXJZKV-RWEWTDSWSA-N
MW388.85 g/mol
LogP5.88
Rot. Bonds3

About 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide

2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide (PubChem CID 53334867) has the molecular formula C23H17ClN2O2 and a molecular weight of 388.85 g/mol. Its IUPAC name is 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide.

Molecular Properties

Compound Name2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide
PubChem CID53334867
Molecular FormulaC23H17ClN2O2
Molecular Weight388.85 g/mol
Exact Mass388.10
IUPAC Name2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide
SMILESCc1ccc(Cl)cc1/N=c1\oc2ccccc2cc1C(=O)Nc1ccccc1
InChIInChI=1S/C23H17ClN2O2/c1-15-11-12-17(24)14-20(15)26-23-19(13-16-7-5-6-10-21(16)28-23)22(27)25-18-8-3-2-4-9-18/h2-14H,1H3,(H,25,27)/b26-23-
InChIKeyALHXAWHKKXJZKV-RWEWTDSWSA-N
XLogP5.88
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.85
LogP ≤ 55.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-2-(2-methylphenyl)iminochromene-3-carboxamide
CID 51370435
N-(4-chlorophenyl)-2-(3,4-dimethylphenyl)iminochromene-3-carboxamide
CID 51367283
2-(2-chlorophenyl)imino-N-(2-methylphenyl)chromene-3-carboxamide
CID 51367890
2-(3-chloro-4-methylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
CID 51368049
2-(3,5-difluorophenyl)imino-N-phenylchromene-3-carboxamide
CID 51367987
N-(4-chlorophenyl)-2-(3-methylsulfanylphenyl)iminochromene-3-carboxamide
CID 51367296
N-(2,4-dimethylphenyl)-2-(5-fluoro-2-methylphenyl)iminochromene-3-carboxamide
CID 51367954
2-(2,3-dimethylphenyl)imino-N-(4-methoxyphenyl)chromene-3-carboxamide
CID 986292
2-(5-chloro-2-fluorophenyl)imino-N-(1,3-thiazol-2-yl)chromene-3-carboxamide
CID 51367701
N-(2,4-dimethylphenyl)-2-(2-methylphenyl)iminochromene-3-carboxamide
CID 51370469
2-(3-chloro-4-methoxyphenyl)imino-N-(4-chlorophenyl)chromene-3-carboxamide
CID 51367328
(2E)-2-[(3,4-dimethylphenyl)sulfonylhydrazinylidene]-N-phenylchromene-3-carboxamide
CID 92666370

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide?
The IUPAC name of 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide (CID 53334867) is 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide.
What is the SMILES notation for 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide?
The canonical SMILES for 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide is Cc1ccc(Cl)cc1/N=c1\oc2ccccc2cc1C(=O)Nc1ccccc1.
What is the InChIKey of 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide?
The InChIKey is ALHXAWHKKXJZKV-RWEWTDSWSA-N. The full InChI is InChI=1S/C23H17ClN2O2/c1-15-11-12-17(24)14-20(15)26-23-19(13-16-7-5-6-10-21(16)28-23)22(27)25-18-8-3-2-4-9-18/h2-14H,1H3,(H,25,27)/b26-23-.
What are the key properties of 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide?
2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide has a molecular weight of 388.85 g/mol, XLogP of 5.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methylphenyl)imino-N-phenylchromene-3-carboxamide is sourced from PubChem (CID 53334867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).