5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide

C18H22N4O3 — CID 167762097

IUPAC5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide
SMILESCNC(=O)c1cc(NCc2ccc(C)c(OC)n2)cc(C(=O)NC)c1
InChIInChI=1S/C18H22N4O3/c1-11-5-6-14(22-18(11)25-4)10-21-15-8-12(16(23)19-2)7-13(9-15)17(24)20-3/h5-9,21H,10H2,1-4H3,(H,19,23)(H,20,24)
InChIKeyJVFGBESAENMCHZ-UHFFFAOYSA-N
MW342.40 g/mol
LogP1.73
Rot. Bonds6

About 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide

5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide (PubChem CID 167762097) has the molecular formula C18H22N4O3 and a molecular weight of 342.40 g/mol. Its IUPAC name is 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide.

Molecular Properties

Compound Name5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide
PubChem CID167762097
Molecular FormulaC18H22N4O3
Molecular Weight342.40 g/mol
Exact Mass342.17
IUPAC Name5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide
SMILESCNC(=O)c1cc(NCc2ccc(C)c(OC)n2)cc(C(=O)NC)c1
InChIInChI=1S/C18H22N4O3/c1-11-5-6-14(22-18(11)25-4)10-21-15-8-12(16(23)19-2)7-13(9-15)17(24)20-3/h5-9,21H,10H2,1-4H3,(H,19,23)(H,20,24)
InChIKeyJVFGBESAENMCHZ-UHFFFAOYSA-N
XLogP1.73
TPSA92.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 51.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide with MolForge

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Related Compounds

6-methoxy-5-methylpyridine-2-carbohydrazide
CID 71463777
1-N,3-N,5-N-trimethylbenzene-1,3,5-tricarboxamide
CID 22943140
4-[(3,4-dimethylanilino)methyl]-N-methylbenzamide
CID 60961314
2-chloro-5-[(6-methoxy-2-pyridinyl)methylamino]-N-methylbenzamide
CID 103347678
3-[(3-methoxyphenyl)methylamino]-N-methylbenzamide
CID 28650224
N-methyl-3-[(2-methylphenyl)methylamino]benzamide
CID 28650229
3-[(6-methoxy-3-pyridinyl)methylamino]-N-methylbenzamide
CID 114936335
4-[(5-chloro-2-methoxyphenyl)methylamino]-N-methylbenzamide
CID 60696773
N-methyl-3-[(1-methyltriazol-4-yl)methylamino]benzamide
CID 62757928
4-[(2-hydroxy-4-methoxyphenyl)methylamino]-N-methylbenzamide
CID 61263985
N-methyl-4-[(4-methyl-1,3-thiazol-2-yl)methylamino]benzamide
CID 104769743
N-methyl-3-(pyridin-4-ylmethylamino)benzamide
CID 28650269

Frequently Asked Questions

What is the IUPAC name of 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide?
The IUPAC name of 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide (CID 167762097) is 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide.
What is the SMILES notation for 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide?
The canonical SMILES for 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide is CNC(=O)c1cc(NCc2ccc(C)c(OC)n2)cc(C(=O)NC)c1.
What is the InChIKey of 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide?
The InChIKey is JVFGBESAENMCHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O3/c1-11-5-6-14(22-18(11)25-4)10-21-15-8-12(16(23)19-2)7-13(9-15)17(24)20-3/h5-9,21H,10H2,1-4H3,(H,19,23)(H,20,24).
What are the key properties of 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide?
5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide has a molecular weight of 342.40 g/mol, XLogP of 1.73, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-methoxy-5-methyl-2-pyridinyl)methylamino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide is sourced from PubChem (CID 167762097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).