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

C10H12N6O — CID 114035922

IUPAC6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide
SMILESCn1ccnc1CNC(=O)c1cncc(N)n1
InChIInChI=1S/C10H12N6O/c1-16-3-2-13-9(16)6-14-10(17)7-4-12-5-8(11)15-7/h2-5H,6H2,1H3,(H2,11,15)(H,14,17)
InChIKeyIFYTVGHXAJYHFC-UHFFFAOYSA-N
MW232.25 g/mol
LogP-0.28
Rot. Bonds3

About 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide

6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide (PubChem CID 114035922) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide
PubChem CID114035922
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC Name6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide
SMILESCn1ccnc1CNC(=O)c1cncc(N)n1
InChIInChI=1S/C10H12N6O/c1-16-3-2-13-9(16)6-14-10(17)7-4-12-5-8(11)15-7/h2-5H,6H2,1H3,(H2,11,15)(H,14,17)
InChIKeyIFYTVGHXAJYHFC-UHFFFAOYSA-N
XLogP-0.28
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-N-[(1-methylimidazol-2-yl)methyl]-1,3-thiazole-4-carboxamide
CID 63293629
4-amino-N-[(1-methylimidazol-2-yl)methyl]pyridine-3-carboxamide
CID 81242142
2-(2-aminoethyl)-N-[(1-methylimidazol-2-yl)methyl]-1,3-thiazole-4-carboxamide
CID 66390133
(1-methylimidazol-2-yl)methylcarbamic acid
CID 89157603
6-amino-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrazine-2-carboxamide
CID 114035828
2,4-diamino-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 63296114
N-[(1-methylimidazol-2-yl)methyl]imidazole-1-carboxamide
CID 63295768
2-[(1-methylimidazol-2-yl)methylamino]-2-oxoacetic acid
CID 63292500
4-amino-N-[(1-methylimidazol-2-yl)methyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 63295942
4-amino-1-ethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-3-carboxamide
CID 65362915
6-amino-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazine-2-carboxamide
CID 106106375
N-[(1-methylimidazol-2-yl)methyl]-1,3-thiazole-2-carboxamide
CID 110467928

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide (CID 114035922) is 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide is Cn1ccnc1CNC(=O)c1cncc(N)n1.
What is the InChIKey of 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide?
The InChIKey is IFYTVGHXAJYHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c1-16-3-2-13-9(16)6-14-10(17)7-4-12-5-8(11)15-7/h2-5H,6H2,1H3,(H2,11,15)(H,14,17).
What are the key properties of 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide?
6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide has a molecular weight of 232.25 g/mol, XLogP of -0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 114035922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).