1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile

C118H114Cl4F2N24O6 — CID 157144969

IUPAC1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile
SMILESCN(C)c1nc(-c2ccc(Cl)cc2)c2cnccn12.COCCN(C)c1nc(-c2ccc(Cl)cc2)c2cnccn12.Clc1ccc(-c2nc(C3CCOCC3)n3ccncc23)cc1.Clc1ccc(-c2nc(CC3CCOCC3)n3ccncc23)cc1.FC(F)c1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1.N#Cc1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1.c1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1
InChIInChI=1S/C18H18ClN3O.C18H17F2N3O.C18H16N4O.C17H16ClN3O.C17H17N3O.C16H17ClN4O.C14H13ClN4/c19-15-3-1-14(2-4-15)18-16-12-20-7-8-22(16)17(21-18)11-13-5-9-23-10-6-13;19-18(20)13-1-3-14(4-2-13)23-16-11-21-8-5-15(16)17(22-23)12-6-9-24-10-7-12;19-11-13-1-3-15(4-2-13)22-17-12-20-8-5-16(17)18(21-22)14-6-9-23-10-7-14;18-14-3-1-12(2-4-14)16-15-11-19-7-8-21(15)17(20-16)13-5-9-22-10-6-13;1-2-4-14(5-3-1)20-16-12-18-9-6-15(16)17(19-20)13-7-10-21-11-8-13;1-20(9-10-22-2)16-19-15(12-3-5-13(17)6-4-12)14-11-18-7-8-21(14)16;1-18(2)14-17-13(10-3-5-11(15)6-4-10)12-9-16-7-8-19(12)14/h1-4,7-8,12-13H,5-6,9-11H2;1-5,8,11-12,18H,6-7,9-10H2;1-5,8,12,14H,6-7,9-10H2;1-4,7-8,11,13H,5-6,9-10H2;1-6,9,12-13H,7-8,10-11H2;3-8,11H,9-10H2,1-2H3;3-9H,1-2H3
InChIKeyAKPHYCGCPIWVAB-UHFFFAOYSA-N
MW2144.18 g/mol
LogP24.96
Rot. Bonds19

About 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile

1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile (PubChem CID 157144969) has the molecular formula C118H114Cl4F2N24O6 and a molecular weight of 2144.18 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile
PubChem CID157144969
Molecular FormulaC118H114Cl4F2N24O6
Molecular Weight2144.18 g/mol
Exact Mass2140.81
IUPAC Name1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile
SMILESCN(C)c1nc(-c2ccc(Cl)cc2)c2cnccn12.COCCN(C)c1nc(-c2ccc(Cl)cc2)c2cnccn12.Clc1ccc(-c2nc(C3CCOCC3)n3ccncc23)cc1.Clc1ccc(-c2nc(CC3CCOCC3)n3ccncc23)cc1.FC(F)c1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1.N#Cc1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1.c1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1
InChIInChI=1S/C18H18ClN3O.C18H17F2N3O.C18H16N4O.C17H16ClN3O.C17H17N3O.C16H17ClN4O.C14H13ClN4/c19-15-3-1-14(2-4-15)18-16-12-20-7-8-22(16)17(21-18)11-13-5-9-23-10-6-13;19-18(20)13-1-3-14(4-2-13)23-16-11-21-8-5-15(16)17(22-23)12-6-9-24-10-7-12;19-11-13-1-3-15(4-2-13)22-17-12-20-8-5-16(17)18(21-22)14-6-9-23-10-7-14;18-14-3-1-12(2-4-14)16-15-11-19-7-8-21(15)17(20-16)13-5-9-22-10-6-13;1-2-4-14(5-3-1)20-16-12-18-9-6-15(16)17(19-20)13-7-10-21-11-8-13;1-20(9-10-22-2)16-19-15(12-3-5-13(17)6-4-12)14-11-18-7-8-21(14)16;1-18(2)14-17-13(10-3-5-11(15)6-4-10)12-9-16-7-8-19(12)14/h1-4,7-8,12-13H,5-6,9-11H2;1-5,8,11-12,18H,6-7,9-10H2;1-5,8,12,14H,6-7,9-10H2;1-4,7-8,11,13H,5-6,9-10H2;1-6,9,12-13H,7-8,10-11H2;3-8,11H,9-10H2,1-2H3;3-9H,1-2H3
InChIKeyAKPHYCGCPIWVAB-UHFFFAOYSA-N
XLogP24.96
TPSA298.54 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds19
Heavy Atoms154
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002144.18
LogP ≤ 524.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile?
The IUPAC name of 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile (CID 157144969) is 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile.
What is the SMILES notation for 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile?
The canonical SMILES for 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile is CN(C)c1nc(-c2ccc(Cl)cc2)c2cnccn12.COCCN(C)c1nc(-c2ccc(Cl)cc2)c2cnccn12.Clc1ccc(-c2nc(C3CCOCC3)n3ccncc23)cc1.Clc1ccc(-c2nc(CC3CCOCC3)n3ccncc23)cc1.FC(F)c1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1.N#Cc1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1.c1ccc(-n2nc(C3CCOCC3)c3ccncc32)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile?
The InChIKey is AKPHYCGCPIWVAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O.C18H17F2N3O.C18H16N4O.C17H16ClN3O.C17H17N3O.C16H17ClN4O.C14H13ClN4/c19-15-3-1-14(2-4-15)18-16-12-20-7-8-22(16)17(21-18)11-13-5-9-23-10-6-13;19-18(20)13-1-3-14(4-2-13)23-16-11-21-8-5-15(16)17(22-23)12-6-9-24-10-7-12;19-11-13-1-3-15(4-2-13)22-17-12-20-8-5-16(17)18(21-22)14-6-9-23-10-7-14;18-14-3-1-12(2-4-14)16-15-11-19-7-8-21(15)17(20-16)13-5-9-22-10-6-13;1-2-4-14(5-3-1)20-16-12-18-9-6-15(16)17(19-20)13-7-10-21-11-8-13;1-20(9-10-22-2)16-19-15(12-3-5-13(17)6-4-12)14-11-18-7-8-21(14)16;1-18(2)14-17-13(10-3-5-11(15)6-4-10)12-9-16-7-8-19(12)14/h1-4,7-8,12-13H,5-6,9-11H2;1-5,8,11-12,18H,6-7,9-10H2;1-5,8,12,14H,6-7,9-10H2;1-4,7-8,11,13H,5-6,9-10H2;1-6,9,12-13H,7-8,10-11H2;3-8,11H,9-10H2,1-2H3;3-9H,1-2H3.
What are the key properties of 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile?
1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile has a molecular weight of 2144.18 g/mol, XLogP of 24.96, 19 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N,N-dimethylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,5-a]pyrazin-3-amine;1-(4-chlorophenyl)-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;1-(4-chlorophenyl)-3-(oxan-4-ylmethyl)imidazo[1,5-a]pyrazine;1-[4-(difluoromethyl)phenyl]-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;3-(oxan-4-yl)-1-phenylpyrazolo[5,4-c]pyridine;4-[3-(oxan-4-yl)pyrazolo[5,4-c]pyridin-1-yl]benzonitrile is sourced from PubChem (CID 157144969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).