4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide

C19H18N6O2 — CID 70936544

IUPAC4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2nc(C)nc(-c3cccnc3)n2)c(C)c1
InChIInChI=1S/C19H18N6O2/c1-11-9-15(23-13(3)26)6-7-16(11)18(27)25-19-22-12(2)21-17(24-19)14-5-4-8-20-10-14/h4-10H,1-3H3,(H,23,26)(H,21,22,24,25,27)
InChIKeyIHMGWVWCIDXEIA-UHFFFAOYSA-N
MW362.39 g/mol
LogP2.76
Rot. Bonds4

About 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide

4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide (PubChem CID 70936544) has the molecular formula C19H18N6O2 and a molecular weight of 362.39 g/mol. Its IUPAC name is 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide.

Molecular Properties

Compound Name4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide
PubChem CID70936544
Molecular FormulaC19H18N6O2
Molecular Weight362.39 g/mol
Exact Mass362.15
IUPAC Name4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2nc(C)nc(-c3cccnc3)n2)c(C)c1
InChIInChI=1S/C19H18N6O2/c1-11-9-15(23-13(3)26)6-7-16(11)18(27)25-19-22-12(2)21-17(24-19)14-5-4-8-20-10-14/h4-10H,1-3H3,(H,23,26)(H,21,22,24,25,27)
InChIKeyIHMGWVWCIDXEIA-UHFFFAOYSA-N
XLogP2.76
TPSA109.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide with MolForge

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Related Compounds

2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)prop-2-enamide
CID 89365852
4-methyl-N-[4-methyl-3-[(4-pyridin-3-yl-1,3,5-triazin-2-yl)amino]phenyl]benzamide
CID 23536120
N-(4-methyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)benzamide
CID 58849719
3-[(4,6-dipyridin-3-yl-1,3,5-triazin-2-yl)amino]-4-methyl-N-(3-methylphenyl)benzamide
CID 164995255
4-bromo-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide
CID 177190731
1-(3-methylphenyl)-3-(4-methylsulfanyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)urea
CID 58655401
4-acetamido-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 2463732
1-(2-methyl-4-pyridin-3-ylphenyl)ethanone
CID 20716212
N-(4-acetyl-3-methylphenyl)acetamide
CID 2737381
4-benzamido-2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide
CID 70814351
N-(4-acetamidophenyl)pyridine-3-carboxamide
CID 766053
N-[4-methyl-3-[(5-pyridin-3-yl-1H-imidazol-2-yl)amino]phenyl]acetamide
CID 24971059

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide?
The IUPAC name of 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide (CID 70936544) is 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide.
What is the SMILES notation for 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide?
The canonical SMILES for 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide is CC(=O)Nc1ccc(C(=O)Nc2nc(C)nc(-c3cccnc3)n2)c(C)c1.
What is the InChIKey of 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide?
The InChIKey is IHMGWVWCIDXEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O2/c1-11-9-15(23-13(3)26)6-7-16(11)18(27)25-19-22-12(2)21-17(24-19)14-5-4-8-20-10-14/h4-10H,1-3H3,(H,23,26)(H,21,22,24,25,27).
What are the key properties of 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide?
4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide has a molecular weight of 362.39 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-2-methyl-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)benzamide is sourced from PubChem (CID 70936544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).