4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide

C23H25N3O3 — CID 109215565

IUPAC4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(CNc2ccnc(C(=O)Nc3cccc(C)c3C)c2)cc1OC
InChIInChI=1S/C23H25N3O3/c1-15-6-5-7-19(16(15)2)26-23(27)20-13-18(10-11-24-20)25-14-17-8-9-21(28-3)22(12-17)29-4/h5-13H,14H2,1-4H3,(H,24,25)(H,26,27)
InChIKeyBPGCMALCYKCPBW-UHFFFAOYSA-N
MW391.47 g/mol
LogP4.58
Rot. Bonds7

About 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide

4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide (PubChem CID 109215565) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
PubChem CID109215565
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC Name4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(CNc2ccnc(C(=O)Nc3cccc(C)c3C)c2)cc1OC
InChIInChI=1S/C23H25N3O3/c1-15-6-5-7-19(16(15)2)26-23(27)20-13-18(10-11-24-20)25-14-17-8-9-21(28-3)22(12-17)29-4/h5-13H,14H2,1-4H3,(H,24,25)(H,26,27)
InChIKeyBPGCMALCYKCPBW-UHFFFAOYSA-N
XLogP4.58
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dimethylphenyl)-4-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109212284
2-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyrimidine-4-carboxamide
CID 109309861
N-(2,3-dimethylphenyl)-4-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109213435
N-(2,4-difluorophenyl)-4-[(3,4-dimethoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109215578
4-(benzylamino)-N-[(3,4-dimethoxyphenyl)methyl]pyridine-2-carboxamide
CID 109209796
N-(3-chloro-2-methylphenyl)-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109210580
6-[(3,4-dimethoxyphenyl)methylamino]-N-(2-methylphenyl)pyrimidine-4-carboxamide
CID 109352420
N-(2-methoxy-5-methylphenyl)-4-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109212313
N-cyclohexyl-4-[(3,4-dimethoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109204782
N-[(3,4-dimethoxyphenyl)methyl]-N'-(2,3-dimethylphenyl)oxamide
CID 108985884
2-N-(2,3-dimethylphenyl)-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092159
N-(2,5-dimethylphenyl)-4-[(3-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109210329

Frequently Asked Questions

What is the IUPAC name of 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide (CID 109215565) is 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide is COc1ccc(CNc2ccnc(C(=O)Nc3cccc(C)c3C)c2)cc1OC.
What is the InChIKey of 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The InChIKey is BPGCMALCYKCPBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c1-15-6-5-7-19(16(15)2)26-23(27)20-13-18(10-11-24-20)25-14-17-8-9-21(28-3)22(12-17)29-4/h5-13H,14H2,1-4H3,(H,24,25)(H,26,27).
What are the key properties of 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide has a molecular weight of 391.47 g/mol, XLogP of 4.58, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3,4-dimethoxyphenyl)methylamino]-N-(2,3-dimethylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109215565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).