5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide

C11H14N6O — CID 113383759

IUPAC5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide
SMILESCN(Cc1nccn1C)C(=O)c1cnc(N)cn1
InChIInChI=1S/C11H14N6O/c1-16-4-3-13-10(16)7-17(2)11(18)8-5-15-9(12)6-14-8/h3-6H,7H2,1-2H3,(H2,12,15)
InChIKeyVQARBYVTKSCJMZ-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.06
Rot. Bonds3

About 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide

5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide (PubChem CID 113383759) has the molecular formula C11H14N6O and a molecular weight of 246.27 g/mol. Its IUPAC name is 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide
PubChem CID113383759
Molecular FormulaC11H14N6O
Molecular Weight246.27 g/mol
Exact Mass246.12
IUPAC Name5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide
SMILESCN(Cc1nccn1C)C(=O)c1cnc(N)cn1
InChIInChI=1S/C11H14N6O/c1-16-4-3-13-10(16)7-17(2)11(18)8-5-15-9(12)6-14-8/h3-6H,7H2,1-2H3,(H2,12,15)
InChIKeyVQARBYVTKSCJMZ-UHFFFAOYSA-N
XLogP0.06
TPSA89.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-5-(methylamino)-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide
CID 107375575
5-cyano-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridine-2-carboxamide
CID 63718606
5-(3-hydroxyprop-1-ynyl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridine-2-carboxamide
CID 63021060
5-amino-2-chloro-N-methyl-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 61116431
5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]-1H-indole-3-carboxamide
CID 63116844
2-bromo-N-methyl-N-[(1-methylimidazol-2-yl)methyl]propanamide
CID 107904600
5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine
CID 63013748
3-amino-4-(dimethylamino)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 61115484
4-amino-1-ethyl-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-3-carboxamide
CID 65357912
2-(3-aminopyrazol-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]acetamide
CID 62112067
5-[methyl-[(1-methylimidazol-2-yl)methyl]carbamoyl]thiophene-2-carboxylic acid
CID 60721954
N-methyl-4-(methylamino)-N-[(1-methylimidazol-2-yl)methyl]pyridine-3-carboxamide
CID 81241836

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide (CID 113383759) is 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide is CN(Cc1nccn1C)C(=O)c1cnc(N)cn1.
What is the InChIKey of 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide?
The InChIKey is VQARBYVTKSCJMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O/c1-16-4-3-13-10(16)7-17(2)11(18)8-5-15-9(12)6-14-8/h3-6H,7H2,1-2H3,(H2,12,15).
What are the key properties of 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide?
5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 0.06, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 113383759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).