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

C23H23N3O3 — CID 109105236

IUPAC5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1cncc(C(=O)NCc2cccc(C)c2)c1
InChIInChI=1S/C23H23N3O3/c1-15-5-4-6-17(9-15)12-25-22(27)18-11-19(14-24-13-18)23(28)26-20-10-16(2)7-8-21(20)29-3/h4-11,13-14H,12H2,1-3H3,(H,25,27)(H,26,28)
InChIKeyMXLAYFJINZALLF-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.89
Rot. Bonds6

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

5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide (PubChem CID 109105236) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
PubChem CID109105236
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1cncc(C(=O)NCc2cccc(C)c2)c1
InChIInChI=1S/C23H23N3O3/c1-15-5-4-6-17(9-15)12-25-22(27)18-11-19(14-24-13-18)23(28)26-20-10-16(2)7-8-21(20)29-3/h4-11,13-14H,12H2,1-3H3,(H,25,27)(H,26,28)
InChIKeyMXLAYFJINZALLF-UHFFFAOYSA-N
XLogP3.89
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-(2,4-dimethylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105208
1-N-benzyl-4-N-(2-methoxy-5-methylphenyl)benzene-1,4-dicarboxamide
CID 109046739
5-N-(2,3-dimethylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105213
3-N-benzyl-5-N-(2-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109105048
5-N-(3-methoxyphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105232
3-N-(3-fluorophenyl)-5-N-(2-methoxy-5-methylphenyl)pyridine-3,5-dicarboxamide
CID 109108948
N-[(3-methylphenyl)methyl]pyrimidine-5-carboxamide
CID 110850770
N-(2-methoxy-5-methylphenyl)-5-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109234541
N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232444
N-(2-methoxy-5-methylphenyl)-2-[(3-methylphenyl)methylamino]acetamide
CID 108996806
5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105762
3-N-(5-chloro-2-methoxyphenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide
CID 109055121

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide (CID 109105236) is 5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide is COc1ccc(C)cc1NC(=O)c1cncc(C(=O)NCc2cccc(C)c2)c1.
What is the InChIKey of 5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
The InChIKey is MXLAYFJINZALLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-15-5-4-6-17(9-15)12-25-22(27)18-11-19(14-24-13-18)23(28)26-20-10-16(2)7-8-21(20)29-3/h4-11,13-14H,12H2,1-3H3,(H,25,27)(H,26,28).
What are the key properties of 5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide?
5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide has a molecular weight of 389.46 g/mol, XLogP of 3.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-methoxy-5-methylphenyl)-3-N-[(3-methylphenyl)methyl]pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109105236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).