1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide

C11H11N7O — CID 80867770

IUPAC1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide
SMILESCNC(=O)c1ccn(-c2nc(N)cn3ccnc23)n1
InChIInChI=1S/C11H11N7O/c1-13-11(19)7-2-4-18(16-7)10-9-14-3-5-17(9)6-8(12)15-10/h2-6H,12H2,1H3,(H,13,19)
InChIKeyJPPAVAIOBYHDIU-UHFFFAOYSA-N
MW257.26 g/mol
LogP-0.14
Rot. Bonds2

About 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide

1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide (PubChem CID 80867770) has the molecular formula C11H11N7O and a molecular weight of 257.26 g/mol. Its IUPAC name is 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide
PubChem CID80867770
Molecular FormulaC11H11N7O
Molecular Weight257.26 g/mol
Exact Mass257.10
IUPAC Name1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide
SMILESCNC(=O)c1ccn(-c2nc(N)cn3ccnc23)n1
InChIInChI=1S/C11H11N7O/c1-13-11(19)7-2-4-18(16-7)10-9-14-3-5-17(9)6-8(12)15-10/h2-6H,12H2,1H3,(H,13,19)
InChIKeyJPPAVAIOBYHDIU-UHFFFAOYSA-N
XLogP-0.14
TPSA103.13 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.26
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide?
The IUPAC name of 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide (CID 80867770) is 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide.
What is the SMILES notation for 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide?
The canonical SMILES for 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide is CNC(=O)c1ccn(-c2nc(N)cn3ccnc23)n1.
What is the InChIKey of 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide?
The InChIKey is JPPAVAIOBYHDIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N7O/c1-13-11(19)7-2-4-18(16-7)10-9-14-3-5-17(9)6-8(12)15-10/h2-6H,12H2,1H3,(H,13,19).
What are the key properties of 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide?
1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide has a molecular weight of 257.26 g/mol, XLogP of -0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-aminoimidazo[1,2-a]pyrazin-8-yl)-N-methylpyrazole-3-carboxamide is sourced from PubChem (CID 80867770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).