1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone

C23H25N7O — CID 139543518

IUPAC1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone
SMILESCC(=O)N1CCn2c(C3CC3)nc(-c3ccc4c(-c5cnn(C)c5)nn(C)c4c3)c2C1
InChIInChI=1S/C23H25N7O/c1-14(31)29-8-9-30-20(13-29)22(25-23(30)15-4-5-15)16-6-7-18-19(10-16)28(3)26-21(18)17-11-24-27(2)12-17/h6-7,10-12,15H,4-5,8-9,13H2,1-3H3
InChIKeyCDUWVBTZSCBATG-UHFFFAOYSA-N
MW415.50 g/mol
LogP3.08
Rot. Bonds3

About 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone

1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone (PubChem CID 139543518) has the molecular formula C23H25N7O and a molecular weight of 415.50 g/mol. Its IUPAC name is 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone.

Molecular Properties

Compound Name1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone
PubChem CID139543518
Molecular FormulaC23H25N7O
Molecular Weight415.50 g/mol
Exact Mass415.21
IUPAC Name1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone
SMILESCC(=O)N1CCn2c(C3CC3)nc(-c3ccc4c(-c5cnn(C)c5)nn(C)c4c3)c2C1
InChIInChI=1S/C23H25N7O/c1-14(31)29-8-9-30-20(13-29)22(25-23(30)15-4-5-15)16-6-7-18-19(10-16)28(3)26-21(18)17-11-24-27(2)12-17/h6-7,10-12,15H,4-5,8-9,13H2,1-3H3
InChIKeyCDUWVBTZSCBATG-UHFFFAOYSA-N
XLogP3.08
TPSA73.77 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.50
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone?
The IUPAC name of 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone (CID 139543518) is 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone.
What is the SMILES notation for 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone?
The canonical SMILES for 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone is CC(=O)N1CCn2c(C3CC3)nc(-c3ccc4c(-c5cnn(C)c5)nn(C)c4c3)c2C1.
What is the InChIKey of 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone?
The InChIKey is CDUWVBTZSCBATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N7O/c1-14(31)29-8-9-30-20(13-29)22(25-23(30)15-4-5-15)16-6-7-18-19(10-16)28(3)26-21(18)17-11-24-27(2)12-17/h6-7,10-12,15H,4-5,8-9,13H2,1-3H3.
What are the key properties of 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone?
1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone has a molecular weight of 415.50 g/mol, XLogP of 3.08, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-cyclopropyl-1-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-6-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]ethanone is sourced from PubChem (CID 139543518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).