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

C15H16ClN3O — CID 114701870

IUPAC5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide
SMILESCNc1ccc(Cl)cc1C(=O)NCc1ccncc1C
InChIInChI=1S/C15H16ClN3O/c1-10-8-18-6-5-11(10)9-19-15(20)13-7-12(16)3-4-14(13)17-2/h3-8,17H,9H2,1-2H3,(H,19,20)
InChIKeyDQWDVBWLXLYJGK-UHFFFAOYSA-N
MW289.77 g/mol
LogP3.02
Rot. Bonds4

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

5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide (PubChem CID 114701870) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide
PubChem CID114701870
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC Name5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide
SMILESCNc1ccc(Cl)cc1C(=O)NCc1ccncc1C
InChIInChI=1S/C15H16ClN3O/c1-10-8-18-6-5-11(10)9-19-15(20)13-7-12(16)3-4-14(13)17-2/h3-8,17H,9H2,1-2H3,(H,19,20)
InChIKeyDQWDVBWLXLYJGK-UHFFFAOYSA-N
XLogP3.02
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methyl-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114701834
5-chloro-N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-(methylamino)benzamide
CID 106049975
3,4,5-trifluoro-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114699471
5-bromo-2-fluoro-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114700595
2-chloro-6-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]pyridine-4-carboxamide
CID 114701806
2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 114701808
2,4-dihydroxy-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 104957549
2-amino-3-chloro-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114698206
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
N-[(2-chlorophenyl)methyl]-4-(methylamino)pyridine-3-carboxamide
CID 81234516
2,4-dibromo-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 104956264

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide?
The IUPAC name of 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide (CID 114701870) is 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide.
What is the SMILES notation for 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide?
The canonical SMILES for 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide is CNc1ccc(Cl)cc1C(=O)NCc1ccncc1C.
What is the InChIKey of 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide?
The InChIKey is DQWDVBWLXLYJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c1-10-8-18-6-5-11(10)9-19-15(20)13-7-12(16)3-4-14(13)17-2/h3-8,17H,9H2,1-2H3,(H,19,20).
What are the key properties of 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide?
5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide has a molecular weight of 289.77 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(methylamino)-N-[(3-methyl-4-pyridinyl)methyl]benzamide is sourced from PubChem (CID 114701870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).