7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide

C22H24N8O2 — CID 139530398

IUPAC7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide
SMILESCNC(=O)c1nc(-c2ccc3c(c2)c(-c2cnn(C)c2)nn3C)c2n1CCN(C(C)=O)C2
InChIInChI=1S/C22H24N8O2/c1-13(31)29-7-8-30-18(12-29)20(25-21(30)22(32)23-2)14-5-6-17-16(9-14)19(26-28(17)4)15-10-24-27(3)11-15/h5-6,9-11H,7-8,12H2,1-4H3,(H,23,32)
InChIKeyZWRNEPFDQBOZIJ-UHFFFAOYSA-N
MW432.49 g/mol
LogP1.56
Rot. Bonds3

About 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide

7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide (PubChem CID 139530398) has the molecular formula C22H24N8O2 and a molecular weight of 432.49 g/mol. Its IUPAC name is 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide.

Molecular Properties

Compound Name7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide
PubChem CID139530398
Molecular FormulaC22H24N8O2
Molecular Weight432.49 g/mol
Exact Mass432.20
IUPAC Name7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide
SMILESCNC(=O)c1nc(-c2ccc3c(c2)c(-c2cnn(C)c2)nn3C)c2n1CCN(C(C)=O)C2
InChIInChI=1S/C22H24N8O2/c1-13(31)29-7-8-30-18(12-29)20(25-21(30)22(32)23-2)14-5-6-17-16(9-14)19(26-28(17)4)15-10-24-27(3)11-15/h5-6,9-11H,7-8,12H2,1-4H3,(H,23,32)
InChIKeyZWRNEPFDQBOZIJ-UHFFFAOYSA-N
XLogP1.56
TPSA102.87 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.49
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide?
The IUPAC name of 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide (CID 139530398) is 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide.
What is the SMILES notation for 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide?
The canonical SMILES for 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide is CNC(=O)c1nc(-c2ccc3c(c2)c(-c2cnn(C)c2)nn3C)c2n1CCN(C(C)=O)C2.
What is the InChIKey of 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide?
The InChIKey is ZWRNEPFDQBOZIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N8O2/c1-13(31)29-7-8-30-18(12-29)20(25-21(30)22(32)23-2)14-5-6-17-16(9-14)19(26-28(17)4)15-10-24-27(3)11-15/h5-6,9-11H,7-8,12H2,1-4H3,(H,23,32).
What are the key properties of 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide?
7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide has a molecular weight of 432.49 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-acetyl-N-methyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-3-carboxamide is sourced from PubChem (CID 139530398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).