N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide

C15H16N4O2 — CID 46421778

IUPACN-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cnc(C)cn2)cc1C
InChIInChI=1S/C15H16N4O2/c1-9-6-12(4-5-13(9)18-11(3)20)19-15(21)14-8-16-10(2)7-17-14/h4-8H,1-3H3,(H,18,20)(H,19,21)
InChIKeyAIYHHWPKVSJWEC-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.30
Rot. Bonds3

About N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide

N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide (PubChem CID 46421778) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide
PubChem CID46421778
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC NameN-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cnc(C)cn2)cc1C
InChIInChI=1S/C15H16N4O2/c1-9-6-12(4-5-13(9)18-11(3)20)19-15(21)14-8-16-10(2)7-17-14/h4-8H,1-3H3,(H,18,20)(H,19,21)
InChIKeyAIYHHWPKVSJWEC-UHFFFAOYSA-N
XLogP2.30
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-iodophenyl)-5-methylpyrazine-2-carboxamide
CID 2388228
N-(4-acetamido-3-methylphenyl)-6-fluoropyridine-2-carboxamide
CID 115497151
5-methyl-N-(4-phenylphenyl)pyrazine-2-carboxamide
CID 7926006
N-(5-acetamido-2-methylphenyl)-5-chloropyrazine-2-carboxamide
CID 103803621
5-(4-chloro-2-methylanilino)-N-(4-chlorophenyl)pyrazine-2-carboxamide
CID 109292823
N-(4-chloro-2-iodophenyl)-5-methylpyrazine-2-carboxamide
CID 113257804
N-(2,3-dimethylphenyl)-5-methylpyrazine-2-carboxamide
CID 16613943
N-(4-chloro-2-methylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide
CID 109290136
5-methyl-N-[3-(methylaminomethyl)phenyl]pyrazine-2-carboxamide
CID 43601855
N-(4-acetamido-3-methylphenyl)-2-bromopyridine-3-carboxamide
CID 103754215
5-methyl-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyrazine-2-carboxamide;dihydrochloride
CID 119547211
N-(4-acetamido-3-methylphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 61274560

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide?
The IUPAC name of N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide (CID 46421778) is N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide?
The canonical SMILES for N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide is CC(=O)Nc1ccc(NC(=O)c2cnc(C)cn2)cc1C.
What is the InChIKey of N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide?
The InChIKey is AIYHHWPKVSJWEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-9-6-12(4-5-13(9)18-11(3)20)19-15(21)14-8-16-10(2)7-17-14/h4-8H,1-3H3,(H,18,20)(H,19,21).
What are the key properties of N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide?
N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamido-3-methylphenyl)-5-methylpyrazine-2-carboxamide is sourced from PubChem (CID 46421778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).