4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide

C18H21N3O4 — CID 109082154

IUPAC4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
SMILESCOCCNC(=O)c1ccnc(C(=O)NCc2ccc(OC)cc2)c1
InChIInChI=1S/C18H21N3O4/c1-24-10-9-20-17(22)14-7-8-19-16(11-14)18(23)21-12-13-3-5-15(25-2)6-4-13/h3-8,11H,9-10,12H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyXJYCHYGUWAAWFX-UHFFFAOYSA-N
MW343.38 g/mol
LogP1.40
Rot. Bonds8

About 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide

4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide (PubChem CID 109082154) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
PubChem CID109082154
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC Name4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
SMILESCOCCNC(=O)c1ccnc(C(=O)NCc2ccc(OC)cc2)c1
InChIInChI=1S/C18H21N3O4/c1-24-10-9-20-17(22)14-7-8-19-16(11-14)18(23)21-12-13-3-5-15(25-2)6-4-13/h3-8,11H,9-10,12H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyXJYCHYGUWAAWFX-UHFFFAOYSA-N
XLogP1.40
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-N-[(4-methoxyphenyl)methyl]-4-N-(3-methoxypropyl)pyridine-2,4-dicarboxamide
CID 109082506
2-N-[(4-methoxyphenyl)methyl]-4-N-propylpyridine-2,4-dicarboxamide
CID 109077649
4-N-benzyl-2-N-(2-methoxyethyl)pyridine-2,4-dicarboxamide
CID 109082319
4-N-[(4-methoxyphenyl)methyl]-2-N-pentylpyridine-2,4-dicarboxamide
CID 109086884
2-N-cyclohexyl-4-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109081527
4-N-[(4-methoxyphenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide
CID 109086890
N-[(4-methoxyphenyl)methyl]-4-methylpyridine-2-carboxamide
CID 110851612
4-N-(1,3-dihydro-2,1,3-benzothiadiazol-5-ylmethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
CID 10181426
2-N-(4-ethylphenyl)-4-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109086903
2-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-N-(2-methoxyethyl)pyridine-2,4-dicarboxamide
CID 109082174
4-chloro-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 7802633
2-N-butyl-4-N-(2-methoxyethyl)pyridine-2,4-dicarboxamide
CID 109079379

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide (CID 109082154) is 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide is COCCNC(=O)c1ccnc(C(=O)NCc2ccc(OC)cc2)c1.
What is the InChIKey of 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide?
The InChIKey is XJYCHYGUWAAWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-24-10-9-20-17(22)14-7-8-19-16(11-14)18(23)21-12-13-3-5-15(25-2)6-4-13/h3-8,11H,9-10,12H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide?
4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide has a molecular weight of 343.38 g/mol, XLogP of 1.40, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-methoxyethyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109082154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).