3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine

C25H23N5O — CID 152504832

IUPAC3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
SMILESNc1nccn2c(C3CCC3)nc(-c3ccc4c(c3)N(O)C(c3ccccc3)C=C4)c12
InChIInChI=1S/C25H23N5O/c26-24-23-22(28-25(18-7-4-8-18)29(23)14-13-27-24)19-10-9-17-11-12-20(30(31)21(17)15-19)16-5-2-1-3-6-16/h1-3,5-6,9-15,18,20,31H,4,7-8H2,(H2,26,27)
InChIKeyYEFSTYKEYBWFFX-UHFFFAOYSA-N
MW409.49 g/mol
LogP5.21
Rot. Bonds3

About 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine

3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine (PubChem CID 152504832) has the molecular formula C25H23N5O and a molecular weight of 409.49 g/mol. Its IUPAC name is 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
PubChem CID152504832
Molecular FormulaC25H23N5O
Molecular Weight409.49 g/mol
Exact Mass409.19
IUPAC Name3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
SMILESNc1nccn2c(C3CCC3)nc(-c3ccc4c(c3)N(O)C(c3ccccc3)C=C4)c12
InChIInChI=1S/C25H23N5O/c26-24-23-22(28-25(18-7-4-8-18)29(23)14-13-27-24)19-10-9-17-11-12-20(30(31)21(17)15-19)16-5-2-1-3-6-16/h1-3,5-6,9-15,18,20,31H,4,7-8H2,(H2,26,27)
InChIKeyYEFSTYKEYBWFFX-UHFFFAOYSA-N
XLogP5.21
TPSA79.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.49
LogP ≤ 55.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

[4-(8-amino-3-cyclobutylimidazo[1,5-a]pyrazin-1-yl)phenyl]-phenylmethanone
CID 44539284
3-cyclobutyl-1-(3-phenylquinoxalin-6-yl)imidazo[1,5-a]pyrazin-8-amine
CID 11560235
3-cyclobutyl-1-(4-methyl-2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
CID 11718383
1-[3-amino-4-(N-benzyl-C-methylcarbonimidoyl)phenyl]-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine
CID 130348820
3-cyclobutyl-1-(3-nitro-4-phenoxyphenyl)imidazo[1,5-a]pyrazin-8-amine
CID 44539191
3-cyclohexyl-1-(2-pyridin-2-ylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
CID 68899663
3-cyclobutyl-1-[3-[(2-phenylphenyl)methoxy]phenyl]imidazo[1,5-a]pyrazin-8-amine
CID 67416927
2-[4-(8-amino-3-cyclobutylimidazo[1,5-a]pyrazin-1-yl)-3-fluorophenyl]benzaldehyde
CID 87657013
carbamic acid;3-cyclohexyl-1-(2-phenoxyquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
CID 68898085
7-(8-amino-3-cyclohexylimidazo[1,5-a]pyrazin-1-yl)-4-methyl-N-phenylquinolin-2-amine
CID 68898257
5-(8-amino-3-cyclopropylimidazo[1,5-a]pyrazin-1-yl)-1,3-benzoxazol-2-amine
CID 172560854
1-(1-benzothiophen-2-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;ethane
CID 143469317

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?
The IUPAC name of 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine (CID 152504832) is 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine.
What is the SMILES notation for 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?
The canonical SMILES for 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine is Nc1nccn2c(C3CCC3)nc(-c3ccc4c(c3)N(O)C(c3ccccc3)C=C4)c12.
What is the InChIKey of 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?
The InChIKey is YEFSTYKEYBWFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N5O/c26-24-23-22(28-25(18-7-4-8-18)29(23)14-13-27-24)19-10-9-17-11-12-20(30(31)21(17)15-19)16-5-2-1-3-6-16/h1-3,5-6,9-15,18,20,31H,4,7-8H2,(H2,26,27).
What are the key properties of 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?
3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine has a molecular weight of 409.49 g/mol, XLogP of 5.21, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-1-(1-hydroxy-2-phenyl-2H-quinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 152504832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).