2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide

C23H23N3O4 — CID 3252781

IUPAC2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(OCC)cc3)nc2)cc1
InChIInChI=1S/C23H23N3O4/c1-3-29-19-10-6-17(7-11-19)25-22(27)16-5-14-21(24-15-16)23(28)26-18-8-12-20(13-9-18)30-4-2/h5-15H,3-4H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyFUIQISMCIDJNPY-UHFFFAOYSA-N
MW405.45 g/mol
LogP4.38
Rot. Bonds8

About 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide

2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide (PubChem CID 3252781) has the molecular formula C23H23N3O4 and a molecular weight of 405.45 g/mol. Its IUPAC name is 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide
PubChem CID3252781
Molecular FormulaC23H23N3O4
Molecular Weight405.45 g/mol
Exact Mass405.17
IUPAC Name2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(OCC)cc3)nc2)cc1
InChIInChI=1S/C23H23N3O4/c1-3-29-19-10-6-17(7-11-19)25-22(27)16-5-14-21(24-15-16)23(28)26-18-8-12-20(13-9-18)30-4-2/h5-15H,3-4H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyFUIQISMCIDJNPY-UHFFFAOYSA-N
XLogP4.38
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.45
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(4-ethoxyphenyl)carbamoyl]pyridine-3-carboxylic acid
CID 43427210
N-(4-ethoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639683
6-(4-acetamidoanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164185
4-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 13388921
N-(6-chloro-3-pyridinyl)-4-ethoxybenzamide
CID 54787908
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 2115172
methyl 4-[[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109164188
N-[4-[(4-bromobenzoyl)amino]phenyl]-4-ethoxybenzamide
CID 23876301
4-ethoxy-N-pyridin-4-ylbenzamide
CID 803153
N-(4-ethoxyphenyl)-4-[(2-hydroxyacetyl)amino]benzamide
CID 8006880
N-(4-ethoxyphenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109153204
6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164189

Frequently Asked Questions

What is the IUPAC name of 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide?
The IUPAC name of 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide (CID 3252781) is 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide.
What is the SMILES notation for 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide?
The canonical SMILES for 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide is CCOc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(OCC)cc3)nc2)cc1.
What is the InChIKey of 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide?
The InChIKey is FUIQISMCIDJNPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4/c1-3-29-19-10-6-17(7-11-19)25-22(27)16-5-14-21(24-15-16)23(28)26-18-8-12-20(13-9-18)30-4-2/h5-15H,3-4H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide?
2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide has a molecular weight of 405.45 g/mol, XLogP of 4.38, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide is sourced from PubChem (CID 3252781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).