5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide

C11H12N6O — CID 113381906

IUPAC5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide
SMILESCc1nccc(CNC(=O)c2cnc(N)cn2)n1
InChIInChI=1S/C11H12N6O/c1-7-13-3-2-8(17-7)4-16-11(18)9-5-15-10(12)6-14-9/h2-3,5-6H,4H2,1H3,(H2,12,15)(H,16,18)
InChIKeyKCURTGDRTLIXLZ-UHFFFAOYSA-N
MW244.26 g/mol
LogP0.09
Rot. Bonds3

About 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide

5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide (PubChem CID 113381906) has the molecular formula C11H12N6O and a molecular weight of 244.26 g/mol. Its IUPAC name is 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide
PubChem CID113381906
Molecular FormulaC11H12N6O
Molecular Weight244.26 g/mol
Exact Mass244.11
IUPAC Name5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide
SMILESCc1nccc(CNC(=O)c2cnc(N)cn2)n1
InChIInChI=1S/C11H12N6O/c1-7-13-3-2-8(17-7)4-16-11(18)9-5-15-10(12)6-14-9/h2-3,5-6H,4H2,1H3,(H2,12,15)(H,16,18)
InChIKeyKCURTGDRTLIXLZ-UHFFFAOYSA-N
XLogP0.09
TPSA106.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-N-[(6-methyl-2-pyridinyl)methyl]pyrazine-2-carboxamide
CID 113381971
N-[(2-methylpyrimidin-4-yl)methyl]-5-(propylamino)pyrazine-2-carboxamide
CID 107374799
2-(2-aminophenyl)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide
CID 61138716
5-amino-N-[(4-methyl-3-pyridinyl)methyl]pyrazine-2-carboxamide
CID 107377156
4-(methylamino)-N-[(2-methylpyrimidin-4-yl)methyl]pyridine-2-carboxamide
CID 55046845
6-(methylamino)-N-[(2-methylpyrimidin-4-yl)methyl]pyridine-2-carboxamide
CID 62238643
4-amino-3,5-dichloro-N-[(2-methylpyrimidin-4-yl)methyl]benzamide
CID 82832714
4-amino-N-[(2-methylpyrimidin-4-yl)methyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076741
4-hydrazinyl-N-[(2-methylpyrimidin-4-yl)methyl]pyridine-3-carboxamide
CID 81255907
N-[(2-methylpyrimidin-4-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 61016997
2,3-dimethyl-4-[(2-methylpyrimidin-4-yl)methylamino]-4-oxobutanoic acid
CID 103497934
4-chloro-N-[(2-methylpyrimidin-4-yl)methyl]pyridine-3-carboxamide
CID 81226586

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide (CID 113381906) is 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide is Cc1nccc(CNC(=O)c2cnc(N)cn2)n1.
What is the InChIKey of 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide?
The InChIKey is KCURTGDRTLIXLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6O/c1-7-13-3-2-8(17-7)4-16-11(18)9-5-15-10(12)6-14-9/h2-3,5-6H,4H2,1H3,(H2,12,15)(H,16,18).
What are the key properties of 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide?
5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide has a molecular weight of 244.26 g/mol, XLogP of 0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[(2-methylpyrimidin-4-yl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 113381906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).