5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide

C16H19N3O — CID 114701834

IUPAC5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide
SMILESCNc1ccc(C)cc1C(=O)NCc1ccncc1C
InChIInChI=1S/C16H19N3O/c1-11-4-5-15(17-3)14(8-11)16(20)19-10-13-6-7-18-9-12(13)2/h4-9,17H,10H2,1-3H3,(H,19,20)
InChIKeyYBQNEFLOLFGGSL-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.67
Rot. Bonds4

About 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide

5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide (PubChem CID 114701834) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide
PubChem CID114701834
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide
SMILESCNc1ccc(C)cc1C(=O)NCc1ccncc1C
InChIInChI=1S/C16H19N3O/c1-11-4-5-15(17-3)14(8-11)16(20)19-10-13-6-7-18-9-12(13)2/h4-9,17H,10H2,1-3H3,(H,19,20)
InChIKeyYBQNEFLOLFGGSL-UHFFFAOYSA-N
XLogP2.67
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114701870
5-methyl-2-(methylamino)-N-[(2-methylphenyl)methyl]benzamide
CID 62509176
2-amino-4-methyl-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114701849
N-[(2-chlorophenyl)methyl]-5-methyl-2-(methylamino)benzamide
CID 62510687
2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 114701808
3,4,5-trifluoro-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114699471
2,4-dihydroxy-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 104957549
3-hydroxy-2-methyl-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114700649
2-hydroxy-3-methyl-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114700654
2,4-dibromo-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 104956264
N-[(2-ethylphenyl)methyl]-4-(methylamino)pyridine-3-carboxamide
CID 81245012
2-bromo-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114700594

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide?
The IUPAC name of 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide (CID 114701834) is 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide.
What is the SMILES notation for 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide?
The canonical SMILES for 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide is CNc1ccc(C)cc1C(=O)NCc1ccncc1C.
What is the InChIKey of 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide?
The InChIKey is YBQNEFLOLFGGSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-11-4-5-15(17-3)14(8-11)16(20)19-10-13-6-7-18-9-12(13)2/h4-9,17H,10H2,1-3H3,(H,19,20).
What are the key properties of 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide?
5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide has a molecular weight of 269.35 g/mol, XLogP of 2.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide is sourced from PubChem (CID 114701834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).