[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone

C84H80Cl2N18O4 — CID 157462005

IUPAC[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone
SMILESCOc1cc(C(=O)N2CCC(c3nc(-c4cc5ccccc5[nH]4)c4c(N)nccn34)CC2)ccc1Cl.Cc1cc(Cl)ccc1C(=O)N1CCC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)CC1.Cc1ccc(C2(C(=O)N3CCC(c4nc(-c5cc6ccccc6[nH]5)c5c(N)nccn45)CC3)CC2)cc1
InChIInChI=1S/C30H30N6O.C27H25ClN6O2.C27H25ClN6O/c1-19-6-8-22(9-7-19)30(12-13-30)29(37)35-15-10-20(11-16-35)28-34-25(26-27(31)32-14-17-36(26)28)24-18-21-4-2-3-5-23(21)33-24;1-36-22-15-18(6-7-19(22)28)27(35)33-11-8-16(9-12-33)26-32-23(24-25(29)30-10-13-34(24)26)21-14-17-4-2-3-5-20(17)31-21;1-16-14-19(28)6-7-20(16)27(35)33-11-8-17(9-12-33)26-32-23(24-25(29)30-10-13-34(24)26)22-15-18-4-2-3-5-21(18)31-22/h2-9,14,17-18,20,33H,10-13,15-16H2,1H3,(H2,31,32);2-7,10,13-16,31H,8-9,11-12H2,1H3,(H2,29,30);2-7,10,13-15,17,31H,8-9,11-12H2,1H3,(H2,29,30)
InChIKeyBUANLZCGBSUGEK-UHFFFAOYSA-N
MW1476.59 g/mol
LogP15.79
Rot. Bonds11

About [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone

[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone (PubChem CID 157462005) has the molecular formula C84H80Cl2N18O4 and a molecular weight of 1476.59 g/mol. Its IUPAC name is [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone.

Molecular Properties

Compound Name[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone
PubChem CID157462005
Molecular FormulaC84H80Cl2N18O4
Molecular Weight1476.59 g/mol
Exact Mass1474.60
IUPAC Name[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone
SMILESCOc1cc(C(=O)N2CCC(c3nc(-c4cc5ccccc5[nH]4)c4c(N)nccn34)CC2)ccc1Cl.Cc1cc(Cl)ccc1C(=O)N1CCC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)CC1.Cc1ccc(C2(C(=O)N3CCC(c4nc(-c5cc6ccccc6[nH]5)c5c(N)nccn45)CC3)CC2)cc1
InChIInChI=1S/C30H30N6O.C27H25ClN6O2.C27H25ClN6O/c1-19-6-8-22(9-7-19)30(12-13-30)29(37)35-15-10-20(11-16-35)28-34-25(26-27(31)32-14-17-36(26)28)24-18-21-4-2-3-5-23(21)33-24;1-36-22-15-18(6-7-19(22)28)27(35)33-11-8-16(9-12-33)26-32-23(24-25(29)30-10-13-34(24)26)21-14-17-4-2-3-5-20(17)31-21;1-16-14-19(28)6-7-20(16)27(35)33-11-8-17(9-12-33)26-32-23(24-25(29)30-10-13-34(24)26)22-15-18-4-2-3-5-21(18)31-22/h2-9,14,17-18,20,33H,10-13,15-16H2,1H3,(H2,31,32);2-7,10,13-16,31H,8-9,11-12H2,1H3,(H2,29,30);2-7,10,13-15,17,31H,8-9,11-12H2,1H3,(H2,29,30)
InChIKeyBUANLZCGBSUGEK-UHFFFAOYSA-N
XLogP15.79
TPSA286.16 Ų
H-Bond Donors6
H-Bond Acceptors16
Rotatable Bonds11
Heavy Atoms108
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001476.59
LogP ≤ 515.79
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1016

Analyze [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone with MolForge

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Related Compounds

CID 160498773
CID 160498773
(3R,4S)-3-[5-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]-1,5,7,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl]-4-ethyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-1-[12-[(3R,4S)-4-ethyl-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]-1,5,7,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-5-yl]ethanone
CID 170309793
[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone
CID 25170788
[4-[8-amino-1-[4-methyl-5-[(Z)-prop-1-enyl]-1H-pyrrol-2-yl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone
CID 143469577
1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]-2,3-dihydroindole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(1S)-1-phenylpropyl]indole-4-carboxamide;4-[(3-chlorophenyl)methyl]pyrimidin-2-amine;1-(2,6-diaminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;methane;sulfane
CID 157129565
CID 157134319
CID 157134319
1-[4-[[2-(4-Chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;3-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-6-yl]benzamide;2-[3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-6-yl]benzonitrile
CID 157157950
N-benzyl-N-methylpyridin-2-amine;1-(5-chloro-1H-indol-2-yl)ethanone;1-chloro-4-(1-phenylethyl)benzene;ethane;1-[(3-methoxyphenyl)methyl]piperidine;methyl 4-(13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-ylidene)piperidine-1-carboxylate;5-methyl-1H-imidazole;2-(5-methyl-1H-imidazol-4-yl)ethanamine;2-(2-phenyl-1H-imidazol-5-yl)ethanamine
CID 157163074
1-[5-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carbonyl]thiophen-2-yl]ethanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone
CID 157397477
1-[4-[[2-(4-Chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]propan-1-one;[4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;3-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-6-yl]benzamide
CID 157436997
3-chloro-N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-N-propylbenzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3,4-dimethyl-N-(3-methylbutyl)benzamide;N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-4-methyl-N-(3-methylbutyl)benzamide;N-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-2-yl]methyl]-2-(2-methoxyphenyl)-N-(3-methylbutyl)acetamide;3-methoxy-N-(2-methylpropyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
CID 157479956
N-benzyl-N-methylpyridin-2-amine;1-chloro-4-(1-phenylethyl)benzene;5-chloro-2-prop-1-en-2-yl-1H-indole;ethane;1-[(3-methoxyphenyl)methyl]piperidine;methyl 4-(13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-ylidene)piperidine-1-carboxylate;5-methyl-1H-imidazole;2-(5-methyl-1H-imidazol-4-yl)ethanamine;2-(2-phenyl-1H-imidazol-5-yl)ethanamine
CID 157492138

Frequently Asked Questions

What is the IUPAC name of [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone?
The IUPAC name of [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone (CID 157462005) is [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone.
What is the SMILES notation for [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone?
The canonical SMILES for [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone is COc1cc(C(=O)N2CCC(c3nc(-c4cc5ccccc5[nH]4)c4c(N)nccn34)CC2)ccc1Cl.Cc1cc(Cl)ccc1C(=O)N1CCC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)CC1.Cc1ccc(C2(C(=O)N3CCC(c4nc(-c5cc6ccccc6[nH]5)c5c(N)nccn45)CC3)CC2)cc1.
What is the InChIKey of [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone?
The InChIKey is BUANLZCGBSUGEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30N6O.C27H25ClN6O2.C27H25ClN6O/c1-19-6-8-22(9-7-19)30(12-13-30)29(37)35-15-10-20(11-16-35)28-34-25(26-27(31)32-14-17-36(26)28)24-18-21-4-2-3-5-23(21)33-24;1-36-22-15-18(6-7-19(22)28)27(35)33-11-8-16(9-12-33)26-32-23(24-25(29)30-10-13-34(24)26)21-14-17-4-2-3-5-20(17)31-21;1-16-14-19(28)6-7-20(16)27(35)33-11-8-17(9-12-33)26-32-23(24-25(29)30-10-13-34(24)26)22-15-18-4-2-3-5-21(18)31-22/h2-9,14,17-18,20,33H,10-13,15-16H2,1H3,(H2,31,32);2-7,10,13-16,31H,8-9,11-12H2,1H3,(H2,29,30);2-7,10,13-15,17,31H,8-9,11-12H2,1H3,(H2,29,30).
What are the key properties of [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone?
[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone has a molecular weight of 1476.59 g/mol, XLogP of 15.79, 11 rotatable bonds, 6 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-3-methoxyphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-(4-chloro-2-methylphenyl)methanone;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(4-methylphenyl)cyclopropyl]methanone is sourced from PubChem (CID 157462005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).