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

C22H21N3O3 — CID 109105232

IUPAC5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCOc1cccc(NC(=O)c2cncc(C(=O)NCc3cccc(C)c3)c2)c1
InChIInChI=1S/C22H21N3O3/c1-15-5-3-6-16(9-15)12-24-21(26)17-10-18(14-23-13-17)22(27)25-19-7-4-8-20(11-19)28-2/h3-11,13-14H,12H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyUYICIZISVPXHDC-UHFFFAOYSA-N
MW375.43 g/mol
LogP3.58
Rot. Bonds6

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

5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide (PubChem CID 109105232) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is 5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
PubChem CID109105232
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC Name5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCOc1cccc(NC(=O)c2cncc(C(=O)NCc3cccc(C)c3)c2)c1
InChIInChI=1S/C22H21N3O3/c1-15-5-3-6-16(9-15)12-24-21(26)17-10-18(14-23-13-17)22(27)25-19-7-4-8-20(11-19)28-2/h3-11,13-14H,12H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyUYICIZISVPXHDC-UHFFFAOYSA-N
XLogP3.58
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(3-methoxyphenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 109047690
5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105236
1-N-benzyl-4-N-(3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109046735
4-N-(3-methylphenyl)-1-N-[(3-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046885
5-(benzylamino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109231885
5-N-(2,4-dimethylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105208
methyl 3-[[5-[(3-methylphenyl)methylcarbamoyl]-3-pyridinyl]amino]benzoate
CID 109232319
N-[(3-methoxyphenyl)methyl]-5-propan-2-yloxypyridine-3-carboxamide
CID 53138000
5-N-(2,3-dimethylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105213
5-(2,4-dimethylanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109242737
N-[3-[[[2-(3-methoxyphenyl)acetyl]amino]methyl]phenyl]pyridine-3-carboxamide
CID 108926458
5-N-(4-methoxyphenyl)-3-N-(pyridin-4-ylmethyl)pyridine-3,5-dicarboxamide
CID 109106154

Frequently Asked Questions

What is the IUPAC name of 5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide (CID 109105232) is 5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide is COc1cccc(NC(=O)c2cncc(C(=O)NCc3cccc(C)c3)c2)c1.
What is the InChIKey of 5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
The InChIKey is UYICIZISVPXHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-15-5-3-6-16(9-15)12-24-21(26)17-10-18(14-23-13-17)22(27)25-19-7-4-8-20(11-19)28-2/h3-11,13-14H,12H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide has a molecular weight of 375.43 g/mol, XLogP of 3.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109105232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).