N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide

C106H110FN15O18S5 — CID 158660449

IUPACN-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide
SMILESCc1cc(-c2cc(CS(C)(=O)=O)ccc2Cc2ccc(F)cc2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2Cc2ccccc2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2OC2CCCCC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2OCC(C)(C)C)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2Oc2cccnc2)n2cc[nH]c(=O)c12
InChIInChI=1S/C23H21FN2O3S.C22H21N3O3S.C21H25N3O4S.C20H18N4O4S.C20H25N3O4S/c1-15-11-21(26-10-9-25-23(27)22(15)26)20-13-17(14-30(2,28)29)3-6-18(20)12-16-4-7-19(24)8-5-16;1-15-12-20(25-11-10-23-22(26)21(15)25)19-14-18(24-29(2,27)28)9-8-17(19)13-16-6-4-3-5-7-16;1-14-12-18(24-11-10-22-21(25)20(14)24)17-13-15(23-29(2,26)27)8-9-19(17)28-16-6-4-3-5-7-16;1-13-10-17(24-9-8-22-20(25)19(13)24)16-11-14(23-29(2,26)27)5-6-18(16)28-15-4-3-7-21-12-15;1-13-10-16(23-9-8-21-19(24)18(13)23)15-11-14(22-28(5,25)26)6-7-17(15)27-12-20(2,3)4/h3-11,13H,12,14H2,1-2H3,(H,25,27);3-12,14,24H,13H2,1-2H3,(H,23,26);8-13,16,23H,3-7H2,1-2H3,(H,22,25);3-12,23H,1-2H3,(H,22,25);6-11,22H,12H2,1-5H3,(H,21,24)
InChIKeyICRPCMGRUDKHET-UHFFFAOYSA-N
MW2061.47 g/mol
LogP17.69
Rot. Bonds25

About N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide

N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide (PubChem CID 158660449) has the molecular formula C106H110FN15O18S5 and a molecular weight of 2061.47 g/mol. Its IUPAC name is N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide
PubChem CID158660449
Molecular FormulaC106H110FN15O18S5
Molecular Weight2061.47 g/mol
Exact Mass2059.67
IUPAC NameN-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide
SMILESCc1cc(-c2cc(CS(C)(=O)=O)ccc2Cc2ccc(F)cc2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2Cc2ccccc2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2OC2CCCCC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2OCC(C)(C)C)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2Oc2cccnc2)n2cc[nH]c(=O)c12
InChIInChI=1S/C23H21FN2O3S.C22H21N3O3S.C21H25N3O4S.C20H18N4O4S.C20H25N3O4S/c1-15-11-21(26-10-9-25-23(27)22(15)26)20-13-17(14-30(2,28)29)3-6-18(20)12-16-4-7-19(24)8-5-16;1-15-12-20(25-11-10-23-22(26)21(15)25)19-14-18(24-29(2,27)28)9-8-17(19)13-16-6-4-3-5-7-16;1-14-12-18(24-11-10-22-21(25)20(14)24)17-13-15(23-29(2,26)27)8-9-19(17)28-16-6-4-3-5-7-16;1-13-10-17(24-9-8-22-20(25)19(13)24)16-11-14(23-29(2,26)27)5-6-18(16)28-15-4-3-7-21-12-15;1-13-10-16(23-9-8-21-19(24)18(13)23)15-11-14(22-28(5,25)26)6-7-17(15)27-12-20(2,3)4/h3-11,13H,12,14H2,1-2H3,(H,25,27);3-12,14,24H,13H2,1-2H3,(H,23,26);8-13,16,23H,3-7H2,1-2H3,(H,22,25);3-12,23H,1-2H3,(H,22,25);6-11,22H,12H2,1-5H3,(H,21,24)
InChIKeyICRPCMGRUDKHET-UHFFFAOYSA-N
XLogP17.69
TPSA445.75 Ų
H-Bond Donors9
H-Bond Acceptors24
Rotatable Bonds25
Heavy Atoms145
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002061.47
LogP ≤ 517.69
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1024

Analyze N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide?
The IUPAC name of N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide (CID 158660449) is N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide.
What is the SMILES notation for N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide?
The canonical SMILES for N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide is Cc1cc(-c2cc(CS(C)(=O)=O)ccc2Cc2ccc(F)cc2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2Cc2ccccc2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2OC2CCCCC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2OCC(C)(C)C)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)ccc2Oc2cccnc2)n2cc[nH]c(=O)c12.
What is the InChIKey of N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide?
The InChIKey is ICRPCMGRUDKHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21FN2O3S.C22H21N3O3S.C21H25N3O4S.C20H18N4O4S.C20H25N3O4S/c1-15-11-21(26-10-9-25-23(27)22(15)26)20-13-17(14-30(2,28)29)3-6-18(20)12-16-4-7-19(24)8-5-16;1-15-12-20(25-11-10-23-22(26)21(15)25)19-14-18(24-29(2,27)28)9-8-17(19)13-16-6-4-3-5-7-16;1-14-12-18(24-11-10-22-21(25)20(14)24)17-13-15(23-29(2,26)27)8-9-19(17)28-16-6-4-3-5-7-16;1-13-10-17(24-9-8-22-20(25)19(13)24)16-11-14(23-29(2,26)27)5-6-18(16)28-15-4-3-7-21-12-15;1-13-10-16(23-9-8-21-19(24)18(13)23)15-11-14(22-28(5,25)26)6-7-17(15)27-12-20(2,3)4/h3-11,13H,12,14H2,1-2H3,(H,25,27);3-12,14,24H,13H2,1-2H3,(H,23,26);8-13,16,23H,3-7H2,1-2H3,(H,22,25);3-12,23H,1-2H3,(H,22,25);6-11,22H,12H2,1-5H3,(H,21,24).
What are the key properties of N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide?
N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide has a molecular weight of 2061.47 g/mol, XLogP of 17.69, 25 rotatable bonds, 9 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-benzyl-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-cyclohexyloxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;N-[4-(2,2-dimethylpropoxy)-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-[(4-fluorophenyl)methyl]-5-(methylsulfonylmethyl)phenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-4-pyridin-3-yloxyphenyl]methanesulfonamide is sourced from PubChem (CID 158660449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).