4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine

C80H85N19O3 — CID 157108790

IUPAC4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine
SMILESCC(C)(C)OC(=O)N1CC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)C1.Nc1nccn2c(C3CCC(C(=O)NCCC4=CCCCC4)CC3)nc(-c3cc4ccccc4[nH]3)c12.Nc1nccn2c(C3CCN(Cc4cnc5ccccc5c4)CC3)nc(-c3cc4ccccc4[nH]3)c12
InChIInChI=1S/C29H27N7.C29H34N6O.C22H24N6O2/c30-28-27-26(25-16-22-6-2-4-8-24(22)33-25)34-29(36(27)14-11-31-28)20-9-12-35(13-10-20)18-19-15-21-5-1-3-7-23(21)32-17-19;30-27-26-25(24-18-22-8-4-5-9-23(22)33-24)34-28(35(26)17-16-31-27)20-10-12-21(13-11-20)29(36)32-15-14-19-6-2-1-3-7-19;1-22(2,3)30-21(29)27-11-14(12-27)20-26-17(18-19(23)24-8-9-28(18)20)16-10-13-6-4-5-7-15(13)25-16/h1-8,11,14-17,20,33H,9-10,12-13,18H2,(H2,30,31);4-6,8-9,16-18,20-21,33H,1-3,7,10-15H2,(H2,30,31)(H,32,36);4-10,14,25H,11-12H2,1-3H3,(H2,23,24)
InChIKeyAGPLBIWPLNJLJT-UHFFFAOYSA-N
MW1360.69 g/mol
LogP14.92
Rot. Bonds12

About 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine

4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine (PubChem CID 157108790) has the molecular formula C80H85N19O3 and a molecular weight of 1360.69 g/mol. Its IUPAC name is 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine.

Molecular Properties

Compound Name4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine
PubChem CID157108790
Molecular FormulaC80H85N19O3
Molecular Weight1360.69 g/mol
Exact Mass1359.71
IUPAC Name4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine
SMILESCC(C)(C)OC(=O)N1CC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)C1.Nc1nccn2c(C3CCC(C(=O)NCCC4=CCCCC4)CC3)nc(-c3cc4ccccc4[nH]3)c12.Nc1nccn2c(C3CCN(Cc4cnc5ccccc5c4)CC3)nc(-c3cc4ccccc4[nH]3)c12
InChIInChI=1S/C29H27N7.C29H34N6O.C22H24N6O2/c30-28-27-26(25-16-22-6-2-4-8-24(22)33-25)34-29(36(27)14-11-31-28)20-9-12-35(13-10-20)18-19-15-21-5-1-3-7-23(21)32-17-19;30-27-26-25(24-18-22-8-4-5-9-23(22)33-24)34-28(35(26)17-16-31-27)20-10-12-21(13-11-20)29(36)32-15-14-19-6-2-1-3-7-19;1-22(2,3)30-21(29)27-11-14(12-27)20-26-17(18-19(23)24-8-9-28(18)20)16-10-13-6-4-5-7-15(13)25-16/h1-8,11,14-17,20,33H,9-10,12-13,18H2,(H2,30,31);4-6,8-9,16-18,20-21,33H,1-3,7,10-15H2,(H2,30,31)(H,32,36);4-10,14,25H,11-12H2,1-3H3,(H2,23,24)
InChIKeyAGPLBIWPLNJLJT-UHFFFAOYSA-N
XLogP14.92
TPSA290.77 Ų
H-Bond Donors7
H-Bond Acceptors17
Rotatable Bonds12
Heavy Atoms102
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001360.69
LogP ≤ 514.92
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine with MolForge

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

Launch Full Analysis

Related Compounds

1-[1-[[9-ethyl-2-(5-fluoroindol-1-yl)-6-morpholin-4-ylpurin-8-yl]methyl]piperidin-4-yl]-4-[[[1-[[2-(1H-indol-3-yl)-9-methyl-6-morpholin-4-ylpurin-8-yl]methyl]piperidin-4-yl]-methylamino]methyl]pyrrolidin-2-one
CID 90775981
tert-butyl 3-[[[(7S)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carbonyl]amino]methyl]azetidine-1-carboxylate;tert-butyl 3-[[[(7S)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carbonyl]amino]methyl]pyrrolidine-1-carboxylate;(7S)-N-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[(1-methylpyrrol-2-yl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[(4-propanoylcyclohexyl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide
CID 157087798
4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[(1S)-1-phenylethyl]cyclohexane-1-carboxamide;3-[1-(benzenesulfonyl)piperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-[1-(3,3,3-trifluoropropylsulfonyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine
CID 157650926
(7S)-N-[3-amino-2-(methyliminomethyl)prop-2-enyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;tert-butyl 3-[[[(7S)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carbonyl]amino]methyl]azetidine-1-carboxylate;tert-butyl 3-[[[(7S)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carbonyl]amino]methyl]pyrrolidine-1-carboxylate;(7S)-N-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[(1-methylpyrrol-2-yl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[(4-propanoylcyclohexyl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide
CID 158824217
1-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]hex-5-yn-1-one;1-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-3-phenylprop-2-yn-1-one;[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-[1-(trifluoromethyl)cyclopropyl]methanone
CID 160069667
7-benzyl-6-methylidene-2-propoxy-5H-pyrrolo[2,3-d]pyrimidin-4-amine;1-benzyl-2-methylidene-6-(trifluoromethyl)-3H-pyrrolo[3,2-c]pyridin-4-amine;2-N-butyl-6-methylidene-7-[(6-methyl-3-pyridinyl)methyl]-5H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;3,13-dimethyl-1,9,12-triaza-4-azoniatetracyclo[6.5.2.04,15.011,14]pentadeca-4,6,8(15),9,11(14),12-hexaen-10-amine;7-[(4-ethylphenyl)methyl]-2-pentyl-7H-pyrrolo[3,2-d]pyrimidin-4-amine;2-pentyl-7H-purin-6-amine
CID 161606637
CID 161844486
CID 161844486
5-fluoro-2-[(1S)-1-(1H-imidazo[4,5-b]pyridin-7-ylamino)propyl]-3-phenylquinazolin-4-one;5-fluoro-3-phenyl-2-[(1S)-1-(1H-pyrrolo[2,3-b]pyridin-4-ylamino)propyl]quinazolin-4-one;5-fluoro-3-phenyl-2-[(1S)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)propyl]quinazolin-4-one;5-fluoro-3-phenyl-2-[(1S)-3,3,3-trifluoro-1-(7H-purin-6-ylamino)propyl]quinazolin-4-one;5-fluoro-3-phenyl-2-[(1S)-3,3,3-trifluoro-1-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)propyl]quinazolin-4-one
CID 161879556
4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[(1S)-1-phenylethyl]cyclohexane-1-carboxamide;3-[1-(benzenesulfonyl)piperidin-4-yl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-(1-propylsulfonylpiperidin-4-yl)imidazo[1,5-a]pyrazin-8-amine;1-(1H-indol-2-yl)-3-[1-(3,3,3-trifluoropropylsulfonyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine
CID 162079237
CID 16131127
CID 16131127
(SP-4-2)-(7,12-Diethenyl-3,8,13,17-tetramethyl-N,N'-bis(3-((6-methyldipyrido(1,2-a:3',2'-d)imidazol-2-yl)amino)propyl)-21H,23H-porphine-2,18-dipropanamidato(2-)-N21,N22,N23,N24)iron(1+) chloride
CID 16131289
N-(6-MEthyldipyrido(1,2-a:3',2'-d)imidazol-2-yl)-4,19-dioxo-N'-(4-(10,15,20-tris(4-methylphenyl)-21H,23H-porphin-5-yl)phenyl)-5,9,14,18-tetraazadocosanediamide
CID 16131291

Frequently Asked Questions

What is the IUPAC name of 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine?
The IUPAC name of 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine (CID 157108790) is 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine.
What is the SMILES notation for 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine?
The canonical SMILES for 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine is CC(C)(C)OC(=O)N1CC(c2nc(-c3cc4ccccc4[nH]3)c3c(N)nccn23)C1.Nc1nccn2c(C3CCC(C(=O)NCCC4=CCCCC4)CC3)nc(-c3cc4ccccc4[nH]3)c12.Nc1nccn2c(C3CCN(Cc4cnc5ccccc5c4)CC3)nc(-c3cc4ccccc4[nH]3)c12.
What is the InChIKey of 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine?
The InChIKey is AGPLBIWPLNJLJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H27N7.C29H34N6O.C22H24N6O2/c30-28-27-26(25-16-22-6-2-4-8-24(22)33-25)34-29(36(27)14-11-31-28)20-9-12-35(13-10-20)18-19-15-21-5-1-3-7-23(21)32-17-19;30-27-26-25(24-18-22-8-4-5-9-23(22)33-24)34-28(35(26)17-16-31-27)20-10-12-21(13-11-20)29(36)32-15-14-19-6-2-1-3-7-19;1-22(2,3)30-21(29)27-11-14(12-27)20-26-17(18-19(23)24-8-9-28(18)20)16-10-13-6-4-5-7-15(13)25-16/h1-8,11,14-17,20,33H,9-10,12-13,18H2,(H2,30,31);4-6,8-9,16-18,20-21,33H,1-3,7,10-15H2,(H2,30,31)(H,32,36);4-10,14,25H,11-12H2,1-3H3,(H2,23,24).
What are the key properties of 4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine?
4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine has a molecular weight of 1360.69 g/mol, XLogP of 14.92, 12 rotatable bonds, 7 hydrogen bond donors, and 17 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]-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide;tert-butyl 3-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]azetidine-1-carboxylate;1-(1H-indol-2-yl)-3-[1-(quinolin-3-ylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 157108790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).