5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile

C25H23N7O — CID 139558393

IUPAC5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile
SMILESCC1C(=O)N(C)Cc2c(-c3cccc4nc(-c5cnn(C)c5)c(C#N)cc34)nc(C3CC3)n21
InChIInChI=1S/C25H23N7O/c1-14-25(33)30(2)13-21-23(29-24(32(14)21)15-7-8-15)18-5-4-6-20-19(18)9-16(10-26)22(28-20)17-11-27-31(3)12-17/h4-6,9,11-12,14-15H,7-8,13H2,1-3H3
InChIKeyPSWWDDSOCOGNCT-UHFFFAOYSA-N
MW437.51 g/mol
LogP3.78
Rot. Bonds3

About 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile

5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile (PubChem CID 139558393) has the molecular formula C25H23N7O and a molecular weight of 437.51 g/mol. Its IUPAC name is 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile.

Molecular Properties

Compound Name5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile
PubChem CID139558393
Molecular FormulaC25H23N7O
Molecular Weight437.51 g/mol
Exact Mass437.20
IUPAC Name5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile
SMILESCC1C(=O)N(C)Cc2c(-c3cccc4nc(-c5cnn(C)c5)c(C#N)cc34)nc(C3CC3)n21
InChIInChI=1S/C25H23N7O/c1-14-25(33)30(2)13-21-23(29-24(32(14)21)15-7-8-15)18-5-4-6-20-19(18)9-16(10-26)22(28-20)17-11-27-31(3)12-17/h4-6,9,11-12,14-15H,7-8,13H2,1-3H3
InChIKeyPSWWDDSOCOGNCT-UHFFFAOYSA-N
XLogP3.78
TPSA92.63 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.51
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile?
The IUPAC name of 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile (CID 139558393) is 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile.
What is the SMILES notation for 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile?
The canonical SMILES for 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile is CC1C(=O)N(C)Cc2c(-c3cccc4nc(-c5cnn(C)c5)c(C#N)cc34)nc(C3CC3)n21.
What is the InChIKey of 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile?
The InChIKey is PSWWDDSOCOGNCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N7O/c1-14-25(33)30(2)13-21-23(29-24(32(14)21)15-7-8-15)18-5-4-6-20-19(18)9-16(10-26)22(28-20)17-11-27-31(3)12-17/h4-6,9,11-12,14-15H,7-8,13H2,1-3H3.
What are the key properties of 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile?
5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile has a molecular weight of 437.51 g/mol, XLogP of 3.78, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-cyclopropyl-5,7-dimethyl-6-oxo-5,8-dihydroimidazo[1,5-a]pyrazin-1-yl)-2-(1-methylpyrazol-4-yl)quinoline-3-carbonitrile is sourced from PubChem (CID 139558393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).