N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one

C84H93F6N11O15S4 — CID 167710363

IUPACN-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one
SMILESCc1cc(-c2cc(NS(C)(=O)=O)ccc2OC2CCC(F)(F)CC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)cnc2OC2CCCCC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(S(C)(=O)=O)ccc2CC2CCC(F)(F)CC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(S(C)(=O)=O)ccc2OC2CCC(F)(F)CC2)n2cc[nH]c(=O)c12
InChIInChI=1S/C22H24F2N2O3S.C21H23F2N3O4S.C21H22F2N2O4S.C20H24N4O4S/c1-14-11-19(26-10-9-25-21(27)20(14)26)18-13-17(30(2,28)29)4-3-16(18)12-15-5-7-22(23,24)8-6-15;1-13-11-17(26-10-9-24-20(27)19(13)26)16-12-14(25-31(2,28)29)3-4-18(16)30-15-5-7-21(22,23)8-6-15;1-13-11-17(25-10-9-24-20(26)19(13)25)16-12-15(30(2,27)28)3-4-18(16)29-14-5-7-21(22,23)8-6-14;1-13-10-17(24-9-8-21-19(25)18(13)24)16-11-14(23-29(2,26)27)12-22-20(16)28-15-6-4-3-5-7-15/h3-4,9-11,13,15H,5-8,12H2,1-2H3,(H,25,27);3-4,9-12,15,25H,5-8H2,1-2H3,(H,24,27);3-4,9-12,14H,5-8H2,1-2H3,(H,24,26);8-12,15,23H,3-7H2,1-2H3,(H,21,25)
InChIKeyZSVMSRZWPULHKY-UHFFFAOYSA-N
MW1738.99 g/mol
LogP15.35
Rot. Bonds18

About N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one

N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one (PubChem CID 167710363) has the molecular formula C84H93F6N11O15S4 and a molecular weight of 1738.99 g/mol. Its IUPAC name is N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one.

Molecular Properties

Compound NameN-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one
PubChem CID167710363
Molecular FormulaC84H93F6N11O15S4
Molecular Weight1738.99 g/mol
Exact Mass1737.56
IUPAC NameN-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one
SMILESCc1cc(-c2cc(NS(C)(=O)=O)ccc2OC2CCC(F)(F)CC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)cnc2OC2CCCCC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(S(C)(=O)=O)ccc2CC2CCC(F)(F)CC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(S(C)(=O)=O)ccc2OC2CCC(F)(F)CC2)n2cc[nH]c(=O)c12
InChIInChI=1S/C22H24F2N2O3S.C21H23F2N3O4S.C21H22F2N2O4S.C20H24N4O4S/c1-14-11-19(26-10-9-25-21(27)20(14)26)18-13-17(30(2,28)29)4-3-16(18)12-15-5-7-22(23,24)8-6-15;1-13-11-17(26-10-9-24-20(27)19(13)26)16-12-14(25-31(2,28)29)3-4-18(16)30-15-5-7-21(22,23)8-6-15;1-13-11-17(25-10-9-24-20(26)19(13)25)16-12-15(30(2,27)28)3-4-18(16)29-14-5-7-21(22,23)8-6-14;1-13-10-17(24-9-8-21-19(25)18(13)24)16-11-14(23-29(2,26)27)12-22-20(16)28-15-6-4-3-5-7-15/h3-4,9-11,13,15H,5-8,12H2,1-2H3,(H,25,27);3-4,9-12,15,25H,5-8H2,1-2H3,(H,24,27);3-4,9-12,14H,5-8H2,1-2H3,(H,24,26);8-12,15,23H,3-7H2,1-2H3,(H,21,25)
InChIKeyZSVMSRZWPULHKY-UHFFFAOYSA-N
XLogP15.35
TPSA350.28 Ų
H-Bond Donors6
H-Bond Acceptors20
Rotatable Bonds18
Heavy Atoms120
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001738.99
LogP ≤ 515.35
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1020

Analyze N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one?
The IUPAC name of N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one (CID 167710363) is N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one.
What is the SMILES notation for N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one?
The canonical SMILES for N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one is Cc1cc(-c2cc(NS(C)(=O)=O)ccc2OC2CCC(F)(F)CC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(NS(C)(=O)=O)cnc2OC2CCCCC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(S(C)(=O)=O)ccc2CC2CCC(F)(F)CC2)n2cc[nH]c(=O)c12.Cc1cc(-c2cc(S(C)(=O)=O)ccc2OC2CCC(F)(F)CC2)n2cc[nH]c(=O)c12.
What is the InChIKey of N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one?
The InChIKey is ZSVMSRZWPULHKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24F2N2O3S.C21H23F2N3O4S.C21H22F2N2O4S.C20H24N4O4S/c1-14-11-19(26-10-9-25-21(27)20(14)26)18-13-17(30(2,28)29)4-3-16(18)12-15-5-7-22(23,24)8-6-15;1-13-11-17(26-10-9-24-20(27)19(13)26)16-12-14(25-31(2,28)29)3-4-18(16)30-15-5-7-21(22,23)8-6-15;1-13-11-17(25-10-9-24-20(26)19(13)25)16-12-15(30(2,27)28)3-4-18(16)29-14-5-7-21(22,23)8-6-14;1-13-10-17(24-9-8-21-19(25)18(13)24)16-11-14(23-29(2,26)27)12-22-20(16)28-15-6-4-3-5-7-15/h3-4,9-11,13,15H,5-8,12H2,1-2H3,(H,25,27);3-4,9-12,15,25H,5-8H2,1-2H3,(H,24,27);3-4,9-12,14H,5-8H2,1-2H3,(H,24,26);8-12,15,23H,3-7H2,1-2H3,(H,21,25).
What are the key properties of N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one?
N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one has a molecular weight of 1738.99 g/mol, XLogP of 15.35, 18 rotatable bonds, 6 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-cyclohexyloxy-5-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)-3-pyridinyl]methanesulfonamide;6-[2-[(4,4-difluorocyclohexyl)methyl]-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one;N-[4-(4,4-difluorocyclohexyl)oxy-3-(8-methyl-1-oxo-2H-pyrrolo[1,2-a]pyrazin-6-yl)phenyl]methanesulfonamide;6-[2-(4,4-difluorocyclohexyl)oxy-5-methylsulfonylphenyl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one is sourced from PubChem (CID 167710363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).