3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine

C74H64ClN15 — CID 157124509

IUPAC3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine
SMILESCC(C)(C)c1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.CC(C)c1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.Nc1nccn2c(C3CCC3)nc(-c3cc4nc(-c5ccccc5)ccc4cc3Cl)c12
InChIInChI=1S/C25H20ClN5.C25H23N5.C24H21N5/c26-19-13-17-9-10-20(15-5-2-1-3-6-15)29-21(17)14-18(19)22-23-24(27)28-11-12-31(23)25(30-22)16-7-4-8-16;1-25(2,3)24-29-21(22-23(26)27-13-14-30(22)24)18-10-9-17-11-12-19(28-20(17)15-18)16-7-5-4-6-8-16;1-15(2)24-28-21(22-23(25)26-12-13-29(22)24)18-9-8-17-10-11-19(27-20(17)14-18)16-6-4-3-5-7-16/h1-3,5-6,9-14,16H,4,7-8H2,(H2,27,28);4-15H,1-3H3,(H2,26,27);3-15H,1-2H3,(H2,25,26)
InChIKeyAIIYXASTOBSTAS-UHFFFAOYSA-N
MW1198.88 g/mol
LogP16.92
Rot. Bonds8

About 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine

3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine (PubChem CID 157124509) has the molecular formula C74H64ClN15 and a molecular weight of 1198.88 g/mol. Its IUPAC name is 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine
PubChem CID157124509
Molecular FormulaC74H64ClN15
Molecular Weight1198.88 g/mol
Exact Mass1197.52
IUPAC Name3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine
SMILESCC(C)(C)c1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.CC(C)c1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.Nc1nccn2c(C3CCC3)nc(-c3cc4nc(-c5ccccc5)ccc4cc3Cl)c12
InChIInChI=1S/C25H20ClN5.C25H23N5.C24H21N5/c26-19-13-17-9-10-20(15-5-2-1-3-6-15)29-21(17)14-18(19)22-23-24(27)28-11-12-31(23)25(30-22)16-7-4-8-16;1-25(2,3)24-29-21(22-23(26)27-13-14-30(22)24)18-10-9-17-11-12-19(28-20(17)15-18)16-7-5-4-6-8-16;1-15(2)24-28-21(22-23(25)26-12-13-29(22)24)18-9-8-17-10-11-19(27-20(17)14-18)16-6-4-3-5-7-16/h1-3,5-6,9-14,16H,4,7-8H2,(H2,27,28);4-15H,1-3H3,(H2,26,27);3-15H,1-2H3,(H2,25,26)
InChIKeyAIIYXASTOBSTAS-UHFFFAOYSA-N
XLogP16.92
TPSA207.30 Ų
H-Bond Donors3
H-Bond Acceptors15
Rotatable Bonds8
Heavy Atoms90
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001198.88
LogP ≤ 516.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1015

Analyze 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine with MolForge

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Related Compounds

3-[3-[4-[(4-Fluorophenyl)-(4-methylphenyl)methyl]piperazin-1-yl]cyclobutyl]-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
CID 130349045
N-[(3-chlorophenyl)methyl]-4-[7-ethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine;N-[(3,4-difluorophenyl)methyl]-4-[7-ethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine;4-[7-ethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-hexylpyrimidin-2-amine;4-[7-ethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-2-amine
CID 158145853
3-Cyclobutyl-1-(3-phenylquinoxalin-6-yl)imidazo[1,5-a]pyrazin-8-amine;3-cyclobutyl-1-(2-pyridin-2-ylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;3-cyclobutyl-1-(2-pyridin-4-ylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;3-[3-(4-methylpiperazin-1-yl)cyclobutyl]-1-[2-phenyl-4-(trifluoromethyl)quinolin-7-yl]imidazo[1,5-a]pyrazin-8-amine
CID 158861191
3-Cyclobutyl-1-(4-methyl-2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;3-cyclobutyl-1-(2-pyridin-2-ylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;3-cyclobutyl-1-(2-pyridin-3-ylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;3-[3-(4-methylpiperazin-1-yl)cyclobutyl]-1-[2-phenyl-4-(trifluoromethyl)quinolin-7-yl]imidazo[1,5-a]pyrazin-8-amine
CID 159610356
2-[(2S,4S)-4-[8-chloro-6-fluoro-7-(4-fluorophenyl)-4-(2-methylimidazol-1-yl)imidazo[4,5-c]quinolin-1-yl]piperidin-2-yl]acetonitrile
CID 159631057
Bis(3-cyclobutyl-1-(4-methyl-2-phenylquinazolin-7-yl)imidazo[1,5-a]pyrazin-8-amine);3-cyclobutyl-1-(3-phenylquinoxalin-6-yl)imidazo[1,5-a]pyrazin-8-amine;3-[3-(4-methylpiperazin-1-yl)cyclobutyl]-1-[2-phenyl-4-(trifluoromethyl)quinolin-7-yl]imidazo[1,5-a]pyrazin-8-amine
CID 159760696
3-Cyclobutyl-1-(2-pyridin-2-ylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;3-cyclobutyl-1-(2-pyridin-3-ylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;3-cyclobutyl-1-(2-pyridin-4-ylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;3-[3-(4-methylpiperazin-1-yl)cyclobutyl]-1-[2-phenyl-4-(trifluoromethyl)quinolin-7-yl]imidazo[1,5-a]pyrazin-8-amine
CID 160704456
2-[(2S,4S)-4-[8-chloro-6-fluoro-4-(2-methylimidazol-1-yl)-7-phenylimidazo[4,5-c]quinolin-1-yl]piperidin-2-yl]acetonitrile
CID 161211450
4-[4-Chloro-6-[4-[1-[2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[2,3-d]pyrimidin-6-yl]pyrrolidin-3-yl]-3,4-dimethylpiperidin-1-yl]-1,8-naphthyridin-2-yl]-2-fluoro-6-(methyliminomethyl)aniline
CID 168978758
1-(6-Chloro-2-phenyl-7-quinolinyl)-3-cyclobutyl-imidazo[1,5-a]pyrazin-8-amine
CID 11568078
3-[3-[(4-Methylpiperazin-1-yl)methyl]cyclobutyl]-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
CID 16048659
8-[2-[3-Chloro-5-(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline
CID 23391334

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine?
The IUPAC name of 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine (CID 157124509) is 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine.
What is the SMILES notation for 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine?
The canonical SMILES for 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine is CC(C)(C)c1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.CC(C)c1nc(-c2ccc3ccc(-c4ccccc4)nc3c2)c2c(N)nccn12.Nc1nccn2c(C3CCC3)nc(-c3cc4nc(-c5ccccc5)ccc4cc3Cl)c12.
What is the InChIKey of 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine?
The InChIKey is AIIYXASTOBSTAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20ClN5.C25H23N5.C24H21N5/c26-19-13-17-9-10-20(15-5-2-1-3-6-15)29-21(17)14-18(19)22-23-24(27)28-11-12-31(23)25(30-22)16-7-4-8-16;1-25(2,3)24-29-21(22-23(26)27-13-14-30(22)24)18-10-9-17-11-12-19(28-20(17)15-18)16-7-5-4-6-8-16;1-15(2)24-28-21(22-23(25)26-12-13-29(22)24)18-9-8-17-10-11-19(27-20(17)14-18)16-6-4-3-5-7-16/h1-3,5-6,9-14,16H,4,7-8H2,(H2,27,28);4-15H,1-3H3,(H2,26,27);3-15H,1-2H3,(H2,25,26).
What are the key properties of 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine?
3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine has a molecular weight of 1198.88 g/mol, XLogP of 16.92, 8 rotatable bonds, 3 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine;1-(6-chloro-2-phenylquinolin-7-yl)-3-cyclobutylimidazo[1,5-a]pyrazin-8-amine;1-(2-phenylquinolin-7-yl)-3-propan-2-ylimidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 157124509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).