4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide

C66H73N19O4 — CID 91465518

IUPAC4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide
SMILESCC(=O)NCC1CCC(c2nc(-c3cc4cccnc4[nH]3)c3c(N)nccn23)CC1.CC(=O)NCC1CCC(c2nc(-c3cc4ncccc4[nH]3)c3c(N)nccn23)CC1.Cc1cnc(N)c2c(-c3cc4ccccc4o3)nc(C3CCC(C(N)=O)CC3)n12
InChIInChI=1S/2C22H25N7O.C22H23N5O2/c1-13(30)26-12-14-4-6-15(7-5-14)22-28-19(20-21(23)25-9-10-29(20)22)18-11-17-16(27-18)3-2-8-24-17;1-13(30)26-12-14-4-6-15(7-5-14)22-28-18(19-20(23)24-9-10-29(19)22)17-11-16-3-2-8-25-21(16)27-17;1-12-11-25-20(23)19-18(17-10-15-4-2-3-5-16(15)29-17)26-22(27(12)19)14-8-6-13(7-9-14)21(24)28/h2-3,8-11,14-15,27H,4-7,12H2,1H3,(H2,23,25)(H,26,30);2-3,8-11,14-15H,4-7,12H2,1H3,(H2,23,24)(H,25,27)(H,26,30);2-5,10-11,13-14H,6-9H2,1H3,(H2,23,25)(H2,24,28)
InChIKeyDPNUIRPZYIURDX-UHFFFAOYSA-N
MW1196.44 g/mol
LogP10.32
Rot. Bonds11

About 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide

4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide (PubChem CID 91465518) has the molecular formula C66H73N19O4 and a molecular weight of 1196.44 g/mol. Its IUPAC name is 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide.

Molecular Properties

Compound Name4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide
PubChem CID91465518
Molecular FormulaC66H73N19O4
Molecular Weight1196.44 g/mol
Exact Mass1195.61
IUPAC Name4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide
SMILESCC(=O)NCC1CCC(c2nc(-c3cc4cccnc4[nH]3)c3c(N)nccn23)CC1.CC(=O)NCC1CCC(c2nc(-c3cc4ncccc4[nH]3)c3c(N)nccn23)CC1.Cc1cnc(N)c2c(-c3cc4ccccc4o3)nc(C3CCC(C(N)=O)CC3)n12
InChIInChI=1S/2C22H25N7O.C22H23N5O2/c1-13(30)26-12-14-4-6-15(7-5-14)22-28-19(20-21(23)25-9-10-29(20)22)18-11-17-16(27-18)3-2-8-24-17;1-13(30)26-12-14-4-6-15(7-5-14)22-28-18(19-20(23)24-9-10-29(19)22)17-11-16-3-2-8-25-21(16)27-17;1-12-11-25-20(23)19-18(17-10-15-4-2-3-5-16(15)29-17)26-22(27(12)19)14-8-6-13(7-9-14)21(24)28/h2-3,8-11,14-15,27H,4-7,12H2,1H3,(H2,23,25)(H,26,30);2-3,8-11,14-15H,4-7,12H2,1H3,(H2,23,24)(H,25,27)(H,26,30);2-5,10-11,13-14H,6-9H2,1H3,(H2,23,25)(H2,24,28)
InChIKeyDPNUIRPZYIURDX-UHFFFAOYSA-N
XLogP10.32
TPSA340.42 Ų
H-Bond Donors8
H-Bond Acceptors18
Rotatable Bonds11
Heavy Atoms89
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001196.44
LogP ≤ 510.32
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1018

Analyze 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide?
The IUPAC name of 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide (CID 91465518) is 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide.
What is the SMILES notation for 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide?
The canonical SMILES for 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide is CC(=O)NCC1CCC(c2nc(-c3cc4cccnc4[nH]3)c3c(N)nccn23)CC1.CC(=O)NCC1CCC(c2nc(-c3cc4ncccc4[nH]3)c3c(N)nccn23)CC1.Cc1cnc(N)c2c(-c3cc4ccccc4o3)nc(C3CCC(C(N)=O)CC3)n12.
What is the InChIKey of 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide?
The InChIKey is DPNUIRPZYIURDX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H25N7O.C22H23N5O2/c1-13(30)26-12-14-4-6-15(7-5-14)22-28-19(20-21(23)25-9-10-29(20)22)18-11-17-16(27-18)3-2-8-24-17;1-13(30)26-12-14-4-6-15(7-5-14)22-28-18(19-20(23)24-9-10-29(19)22)17-11-16-3-2-8-25-21(16)27-17;1-12-11-25-20(23)19-18(17-10-15-4-2-3-5-16(15)29-17)26-22(27(12)19)14-8-6-13(7-9-14)21(24)28/h2-3,8-11,14-15,27H,4-7,12H2,1H3,(H2,23,25)(H,26,30);2-3,8-11,14-15H,4-7,12H2,1H3,(H2,23,24)(H,25,27)(H,26,30);2-5,10-11,13-14H,6-9H2,1H3,(H2,23,25)(H2,24,28).
What are the key properties of 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide?
4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide has a molecular weight of 1196.44 g/mol, XLogP of 10.32, 11 rotatable bonds, 8 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[8-amino-1-(1-benzofuran-2-yl)-5-methylimidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;N-[[4-[8-amino-1-(1H-pyrrolo[2,3-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide;N-[[4-[8-amino-1-(1H-pyrrolo[3,2-b]pyridin-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide is sourced from PubChem (CID 91465518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).