4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide

C94H95ClN28O7 — CID 136652089

About 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide

4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide (PubChem CID 136652089) has the molecular formula C94H95ClN28O7 and a molecular weight of 1764.44 g/mol. Its IUPAC name is 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide.

Molecular Properties

• Compound Name: 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide
• PubChem CID: 136652089
• Molecular Formula: C94H95ClN28O7
• Molecular Weight: 1764.44 g/mol
• Exact Mass: 1762.76
• IUPAC Name: 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide
• SMILES: CN(C)C(=O)N1CCC(c2nc(-c3cc4ncccc4o3)c3c(N)nccn23)CC1.CNC(=O)N1CCC(c2nc(-c3cc4cccc(-c5ccccn5)c4[nH]3)c3c(N)nccn23)CC1.Cc1cnc(N)c2c(-c3cc4cccc(Cl)c4[nH]3)nc(C3CCC(C(=O)O)CC3)n12.Nc1nccn2c(C3CCC(C(=O)Nc4cccnc4)CC3)nc(-c3cc4c(=O)[nH]ccc4[nH]3)c12
• InChI: InChI=1S/C26H26N8O.C25H24N8O2.C22H22ClN5O2.C21H23N7O2/c1-28-26(35)33-12-8-16(9-13-33)25-32-22(23-24(27)30-11-14-34(23)25)20-15-17-5-4-6-18(21(17)31-20)19-7-2-3-10-29-19;26-22-21-20(19-12-17-18(31-19)7-9-29-25(17)35)32-23(33(21)11-10-28-22)14-3-5-15(6-4-14)24(34)30-16-2-1-8-27-13-16;1-11-10-25-20(24)19-18(16-9-14-3-2-4-15(23)17(14)26-16)27-21(28(11)19)12-5-7-13(8-6-12)22(29)30;1-26(2)21(29)27-9-5-13(6-10-27)20-25-17(18-19(22)24-8-11-28(18)20)16-12-14-15(30-16)4-3-7-23-14/h2-7,10-11,14-16,31H,8-9,12-13H2,1H3,(H2,27,30)(H,28,35);1-2,7-15,31H,3-6H2,(H2,26,28)(H,29,35)(H,30,34);2-4,9-10,12-13,26H,5-8H2,1H3,(H2,24,25)(H,29,30);3-4,7-8,11-13H,5-6,9-10H2,1-2H3,(H2,22,24)
• InChIKey: WDZHUNYHOJGSKY-UHFFFAOYSA-N
• XLogP: 15.26
• TPSA: 479.17 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 25
• Rotatable Bonds: 12
• Heavy Atoms: 130
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1764.44
LogP ≤ 5	15.26
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide?

The IUPAC name of 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide (CID 136652089) is 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide.

What is the SMILES notation for 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide?

The canonical SMILES for 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide is CN(C)C(=O)N1CCC(c2nc(-c3cc4ncccc4o3)c3c(N)nccn23)CC1.CNC(=O)N1CCC(c2nc(-c3cc4cccc(-c5ccccn5)c4[nH]3)c3c(N)nccn23)CC1.Cc1cnc(N)c2c(-c3cc4cccc(Cl)c4[nH]3)nc(C3CCC(C(=O)O)CC3)n12.Nc1nccn2c(C3CCC(C(=O)Nc4cccnc4)CC3)nc(-c3cc4c(=O)[nH]ccc4[nH]3)c12.

What is the InChIKey of 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide?

The InChIKey is WDZHUNYHOJGSKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N8O.C25H24N8O2.C22H22ClN5O2.C21H23N7O2/c1-28-26(35)33-12-8-16(9-13-33)25-32-22(23-24(27)30-11-14-34(23)25)20-15-17-5-4-6-18(21(17)31-20)19-7-2-3-10-29-19;26-22-21-20(19-12-17-18(31-19)7-9-29-25(17)35)32-23(33(21)11-10-28-22)14-3-5-15(6-4-14)24(34)30-16-2-1-8-27-13-16;1-11-10-25-20(24)19-18(16-9-14-3-2-4-15(23)17(14)26-16)27-21(28(11)19)12-5-7-13(8-6-12)22(29)30;1-26(2)21(29)27-9-5-13(6-10-27)20-25-17(18-19(22)24-8-11-28(18)20)16-12-14-15(30-16)4-3-7-23-14/h2-7,10-11,14-16,31H,8-9,12-13H2,1H3,(H2,27,30)(H,28,35);1-2,7-15,31H,3-6H2,(H2,26,28)(H,29,35)(H,30,34);2-4,9-10,12-13,26H,5-8H2,1H3,(H2,24,25)(H,29,30);3-4,7-8,11-13H,5-6,9-10H2,1-2H3,(H2,22,24).

What are the key properties of 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide?

4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide has a molecular weight of 1764.44 g/mol, XLogP of 15.26, 12 rotatable bonds, 11 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[8-amino-1-(7-chloro-1H-indol-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;4-(8-amino-1-furo[3,2-b]pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(4-oxo-1,5-dihydropyrrolo[3,2-c]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-pyridin-3-ylcyclohexane-1-carboxamide;4-[8-amino-1-(7-pyridin-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N-methylpiperidine-1-carboxamide is sourced from PubChem (CID 136652089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).