5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide

C22H21N3O4 — CID 109105762

IUPAC5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCOc1ccccc1CNC(=O)c1cncc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C22H21N3O4/c1-28-19-9-5-3-7-15(19)14-24-21(26)16-11-17(13-23-12-16)22(27)25-18-8-4-6-10-20(18)29-2/h3-13H,14H2,1-2H3,(H,24,26)(H,25,27)
InChIKeySCGYXVRFYULELK-UHFFFAOYSA-N
MW391.43 g/mol
LogP3.28
Rot. Bonds7

About 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide

5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide (PubChem CID 109105762) has the molecular formula C22H21N3O4 and a molecular weight of 391.43 g/mol. Its IUPAC name is 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide
PubChem CID109105762
Molecular FormulaC22H21N3O4
Molecular Weight391.43 g/mol
Exact Mass391.15
IUPAC Name5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCOc1ccccc1CNC(=O)c1cncc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C22H21N3O4/c1-28-19-9-5-3-7-15(19)14-24-21(26)16-11-17(13-23-12-16)22(27)25-18-8-4-6-10-20(18)29-2/h3-13H,14H2,1-2H3,(H,24,26)(H,25,27)
InChIKeySCGYXVRFYULELK-UHFFFAOYSA-N
XLogP3.28
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.43
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide (CID 109105762) is 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide is COc1ccccc1CNC(=O)c1cncc(C(=O)Nc2ccccc2OC)c1.
What is the InChIKey of 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide?
The InChIKey is SCGYXVRFYULELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O4/c1-28-19-9-5-3-7-15(19)14-24-21(26)16-11-17(13-23-12-16)22(27)25-18-8-4-6-10-20(18)29-2/h3-13H,14H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide?
5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide has a molecular weight of 391.43 g/mol, XLogP of 3.28, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109105762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).