2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide

C19H18N4O — CID 113012661

IUPAC2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide
SMILESCc1ccccc1C(=O)Nc1ccc(NCc2ccccn2)nc1
InChIInChI=1S/C19H18N4O/c1-14-6-2-3-8-17(14)19(24)23-16-9-10-18(22-13-16)21-12-15-7-4-5-11-20-15/h2-11,13H,12H2,1H3,(H,21,22)(H,23,24)
InChIKeyDBGKHYULMFVQSC-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.65
Rot. Bonds5

About 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide

2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide (PubChem CID 113012661) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide
PubChem CID113012661
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC Name2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide
SMILESCc1ccccc1C(=O)Nc1ccc(NCc2ccccn2)nc1
InChIInChI=1S/C19H18N4O/c1-14-6-2-3-8-17(14)19(24)23-16-9-10-18(22-13-16)21-12-15-7-4-5-11-20-15/h2-11,13H,12H2,1H3,(H,21,22)(H,23,24)
InChIKeyDBGKHYULMFVQSC-UHFFFAOYSA-N
XLogP3.65
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-tert-butyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide
CID 113012677
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]-2-methylbenzamide
CID 113012276
N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]butanamide
CID 113012649
2-ethyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]butanamide
CID 113012657
N-[6-(2-hydroxypropylamino)-3-pyridinyl]-2-methylbenzamide
CID 82022480
N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide
CID 113012694
N-(3,4-dimethylphenyl)-5-(pyridin-2-ylmethylamino)pyridine-2-carboxamide
CID 109191075
4-tert-butyl-N-[5-(pyridin-2-ylmethylamino)-2-pyridinyl]benzamide
CID 113027652
2-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide
CID 113023425
N-(3-bromo-4-methylphenyl)-5-(pyridin-2-ylmethylamino)pyrazine-2-carboxamide
CID 109283148
3-methyl-N-[5-(pyridin-2-ylmethylamino)-2-pyridinyl]butanamide
CID 113027627
3-methyl-N-[6-(2-pyridin-2-ylethylamino)-3-pyridinyl]-2-[4-(trifluoromethyl)phenyl]benzamide
CID 142090076

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide?
The IUPAC name of 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide (CID 113012661) is 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide.
What is the SMILES notation for 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide?
The canonical SMILES for 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide is Cc1ccccc1C(=O)Nc1ccc(NCc2ccccn2)nc1.
What is the InChIKey of 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide?
The InChIKey is DBGKHYULMFVQSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c1-14-6-2-3-8-17(14)19(24)23-16-9-10-18(22-13-16)21-12-15-7-4-5-11-20-15/h2-11,13H,12H2,1H3,(H,21,22)(H,23,24).
What are the key properties of 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide?
2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide has a molecular weight of 318.38 g/mol, XLogP of 3.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide is sourced from PubChem (CID 113012661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).