3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide

C23H18N4O3 — CID 109108883

IUPAC3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
SMILESCOc1ccccc1NC(=O)c1cncc(C(=O)Nc2cccc3cccnc23)c1
InChIInChI=1S/C23H18N4O3/c1-30-20-10-3-2-8-18(20)26-22(28)16-12-17(14-24-13-16)23(29)27-19-9-4-6-15-7-5-11-25-21(15)19/h2-14H,1H3,(H,26,28)(H,27,29)
InChIKeyWDXVYULXEJBGDE-UHFFFAOYSA-N
MW398.42 g/mol
LogP4.14
Rot. Bonds5

About 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide

3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide (PubChem CID 109108883) has the molecular formula C23H18N4O3 and a molecular weight of 398.42 g/mol. Its IUPAC name is 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
PubChem CID109108883
Molecular FormulaC23H18N4O3
Molecular Weight398.42 g/mol
Exact Mass398.14
IUPAC Name3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
SMILESCOc1ccccc1NC(=O)c1cncc(C(=O)Nc2cccc3cccnc23)c1
InChIInChI=1S/C23H18N4O3/c1-30-20-10-3-2-8-18(20)26-22(28)16-12-17(14-24-13-16)23(29)27-19-9-4-6-15-7-5-11-25-21(15)19/h2-14H,1H3,(H,26,28)(H,27,29)
InChIKeyWDXVYULXEJBGDE-UHFFFAOYSA-N
XLogP4.14
TPSA93.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.42
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyphenyl)-2-(quinolin-8-ylamino)pyrimidine-5-carboxamide
CID 109269429
3-N-(3,4-dimethylphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109108326
5-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 837055
5-N-(2-methoxyphenyl)-3-N-phenylpyridine-3,5-dicarboxamide
CID 109107789
5-N-(1-phenylethyl)-3-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109105406
3-methoxy-N-quinolin-8-ylnaphthalene-2-carboxamide
CID 952605
5-(2-methoxyanilino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109199751
4-[(2-methoxyphenyl)sulfamoyl]-N-quinolin-8-ylbenzamide
CID 31321858
5-N-(2,6-difluorophenyl)-3-N-(2-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108890
5-N-(2-methoxyphenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108873
5-N-tert-butyl-3-N-(2-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109106949
3-ethoxy-4-methoxy-N-quinolin-8-ylbenzamide
CID 26123353

Frequently Asked Questions

What is the IUPAC name of 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide?
The IUPAC name of 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide (CID 109108883) is 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide.
What is the SMILES notation for 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide?
The canonical SMILES for 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide is COc1ccccc1NC(=O)c1cncc(C(=O)Nc2cccc3cccnc23)c1.
What is the InChIKey of 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide?
The InChIKey is WDXVYULXEJBGDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O3/c1-30-20-10-3-2-8-18(20)26-22(28)16-12-17(14-24-13-16)23(29)27-19-9-4-6-15-7-5-11-25-21(15)19/h2-14H,1H3,(H,26,28)(H,27,29).
What are the key properties of 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide?
3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide has a molecular weight of 398.42 g/mol, XLogP of 4.14, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-methoxyphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide is sourced from PubChem (CID 109108883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).