2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide

C24H21N3O3 — CID 51367828

IUPAC2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
SMILESCCOc1ccc(/N=c2\oc3ccccc3cc2C(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C24H21N3O3/c1-3-29-19-13-11-18(12-14-19)26-24-20(15-17-8-4-5-9-21(17)30-24)23(28)27-22-10-6-7-16(2)25-22/h4-15H,3H2,1-2H3,(H,25,27,28)/b26-24-
InChIKeyCJTQKLNZMZYMCW-LCUIJRPUSA-N
MW399.45 g/mol
LogP5.02
Rot. Bonds5

About 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide

2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide (PubChem CID 51367828) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
PubChem CID51367828
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC Name2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
SMILESCCOc1ccc(/N=c2\oc3ccccc3cc2C(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C24H21N3O3/c1-3-29-19-13-11-18(12-14-19)26-24-20(15-17-8-4-5-9-21(17)30-24)23(28)27-22-10-6-7-16(2)25-22/h4-15H,3H2,1-2H3,(H,25,27,28)/b26-24-
InChIKeyCJTQKLNZMZYMCW-LCUIJRPUSA-N
XLogP5.02
TPSA76.72 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.45
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51370455
2-(3-methoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367823
2-(3-chlorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367843
2-(3-chloro-4-methoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367859
6-bromo-2-(4-methoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51370459
2-(4-ethylphenyl)imino-N-(5-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367761
2-(4-chlorophenyl)imino-7-hydroxy-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 135631616
2-(3-methylphenyl)imino-N-pyridin-2-ylchromene-3-carboxamide
CID 51367703
2-(2-fluoro-4-methylphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367852
methyl 4-[[3-(pyridin-2-ylcarbamoyl)chromen-2-ylidene]amino]benzoate
CID 51367720
2-(3-chloro-2-fluorophenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide
CID 51367847
6-bromo-N-(6-methyl-2-pyridinyl)-2-(4-propan-2-ylphenyl)iminochromene-3-carboxamide
CID 51367342

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide?
The IUPAC name of 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide (CID 51367828) is 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide.
What is the SMILES notation for 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide?
The canonical SMILES for 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide is CCOc1ccc(/N=c2\oc3ccccc3cc2C(=O)Nc2cccc(C)n2)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide?
The InChIKey is CJTQKLNZMZYMCW-LCUIJRPUSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-3-29-19-13-11-18(12-14-19)26-24-20(15-17-8-4-5-9-21(17)30-24)23(28)27-22-10-6-7-16(2)25-22/h4-15H,3H2,1-2H3,(H,25,27,28)/b26-24-.
What are the key properties of 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide?
2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide has a molecular weight of 399.45 g/mol, XLogP of 5.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)imino-N-(6-methyl-2-pyridinyl)chromene-3-carboxamide is sourced from PubChem (CID 51367828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).