N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C94H81F9N24O16S4 — CID 158878160

IUPACN-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC(F)S(=O)(=O)c1ccc(OC(F)F)c(-c2nn(C)cc2NC(=O)c2cnn3cccnc23)c1.CCc1cccc(S(=O)(=O)c2ccc(OC(F)F)c(-c3nn(C)cc3NC(=O)c3cnn4cccnc34)c2)c1.Cc1cccc(S(=O)(=O)c2ccc(OC(F)F)c(-c3nn(C)cc3NC(=O)c3cnn4cccnc34)c2)c1.Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(S(=O)(=O)C3CCCC3)ccc2OC(F)F)n1
InChIInChI=1S/C26H22F2N6O4S.C25H20F2N6O4S.C23H22F2N6O4S.C20H17F3N6O4S/c1-3-16-6-4-7-17(12-16)39(36,37)18-8-9-22(38-26(27)28)19(13-18)23-21(15-33(2)32-23)31-25(35)20-14-30-34-11-5-10-29-24(20)34;1-15-5-3-6-16(11-15)38(35,36)17-7-8-21(37-25(26)27)18(12-17)22-20(14-32(2)31-22)30-24(34)19-13-29-33-10-4-9-28-23(19)33;1-30-13-18(28-22(32)17-12-27-31-10-4-9-26-21(17)31)20(29-30)16-11-15(7-8-19(16)35-23(24)25)36(33,34)14-5-2-3-6-14;1-11(21)34(31,32)12-4-5-16(33-20(22)23)13(8-12)17-15(10-28(2)27-17)26-19(30)14-9-25-29-7-3-6-24-18(14)29/h4-15,26H,3H2,1-2H3,(H,31,35);3-14,25H,1-2H3,(H,30,34);4,7-14,23H,2-3,5-6H2,1H3,(H,28,32);3-11,20H,1-2H3,(H,26,30)
InChIKeyJCRVEYQQQSPRKE-UHFFFAOYSA-N
MW2102.08 g/mol
LogP15.28
Rot. Bonds29

About N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 158878160) has the molecular formula C94H81F9N24O16S4 and a molecular weight of 2102.08 g/mol. Its IUPAC name is N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID158878160
Molecular FormulaC94H81F9N24O16S4
Molecular Weight2102.08 g/mol
Exact Mass2100.50
IUPAC NameN-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC(F)S(=O)(=O)c1ccc(OC(F)F)c(-c2nn(C)cc2NC(=O)c2cnn3cccnc23)c1.CCc1cccc(S(=O)(=O)c2ccc(OC(F)F)c(-c3nn(C)cc3NC(=O)c3cnn4cccnc34)c2)c1.Cc1cccc(S(=O)(=O)c2ccc(OC(F)F)c(-c3nn(C)cc3NC(=O)c3cnn4cccnc34)c2)c1.Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(S(=O)(=O)C3CCCC3)ccc2OC(F)F)n1
InChIInChI=1S/C26H22F2N6O4S.C25H20F2N6O4S.C23H22F2N6O4S.C20H17F3N6O4S/c1-3-16-6-4-7-17(12-16)39(36,37)18-8-9-22(38-26(27)28)19(13-18)23-21(15-33(2)32-23)31-25(35)20-14-30-34-11-5-10-29-24(20)34;1-15-5-3-6-16(11-15)38(35,36)17-7-8-21(37-25(26)27)18(12-17)22-20(14-32(2)31-22)30-24(34)19-13-29-33-10-4-9-28-23(19)33;1-30-13-18(28-22(32)17-12-27-31-10-4-9-26-21(17)31)20(29-30)16-11-15(7-8-19(16)35-23(24)25)36(33,34)14-5-2-3-6-14;1-11(21)34(31,32)12-4-5-16(33-20(22)23)13(8-12)17-15(10-28(2)27-17)26-19(30)14-9-25-29-7-3-6-24-18(14)29/h4-15,26H,3H2,1-2H3,(H,31,35);3-14,25H,1-2H3,(H,30,34);4,7-14,23H,2-3,5-6H2,1H3,(H,28,32);3-11,20H,1-2H3,(H,26,30)
InChIKeyJCRVEYQQQSPRKE-UHFFFAOYSA-N
XLogP15.28
TPSA481.92 Ų
H-Bond Donors4
H-Bond Acceptors36
Rotatable Bonds29
Heavy Atoms147
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002102.08
LogP ≤ 515.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1036

Analyze N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Related Compounds

US11155557, Example 128
CID 146236166
US11155557, Example 127
CID 146236227
N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[(3S)-piperidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164791
N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164794
N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[2-(4-morpholin-4-ylpiperidin-1-yl)-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164795
N-[3-[5-cyclopropylsulfanyl-2-(difluoromethoxy)phenyl]-1-[2-oxo-2-(4-oxopiperidin-1-yl)ethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164796
N-[3-[2-(difluoromethoxy)-5-propan-2-ylsulfanylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164798
N-[1-[2-[4-[(3R)-3-cyanopiperidin-1-yl]piperidin-1-yl]-2-oxoethyl]-3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164802
N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-[(1-piperidin-4-yltriazol-4-yl)methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164805
N-[3-[5-cyclopropylsulfanyl-2-(difluoromethoxy)phenyl]-1-[2-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]-2-oxoethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164806
N-[3-[2-(difluoromethoxy)-5-propan-2-ylsulfanylphenyl]-1-[(1-piperidin-4-yltriazol-4-yl)methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164810
N-[3-[2-(difluoromethoxy)-5-(1,3-difluoropropan-2-ylsulfanyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129164811

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 158878160) is N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is CC(F)S(=O)(=O)c1ccc(OC(F)F)c(-c2nn(C)cc2NC(=O)c2cnn3cccnc23)c1.CCc1cccc(S(=O)(=O)c2ccc(OC(F)F)c(-c3nn(C)cc3NC(=O)c3cnn4cccnc34)c2)c1.Cc1cccc(S(=O)(=O)c2ccc(OC(F)F)c(-c3nn(C)cc3NC(=O)c3cnn4cccnc34)c2)c1.Cn1cc(NC(=O)c2cnn3cccnc23)c(-c2cc(S(=O)(=O)C3CCCC3)ccc2OC(F)F)n1.
What is the InChIKey of N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is JCRVEYQQQSPRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22F2N6O4S.C25H20F2N6O4S.C23H22F2N6O4S.C20H17F3N6O4S/c1-3-16-6-4-7-17(12-16)39(36,37)18-8-9-22(38-26(27)28)19(13-18)23-21(15-33(2)32-23)31-25(35)20-14-30-34-11-5-10-29-24(20)34;1-15-5-3-6-16(11-15)38(35,36)17-7-8-21(37-25(26)27)18(12-17)22-20(14-32(2)31-22)30-24(34)19-13-29-33-10-4-9-28-23(19)33;1-30-13-18(28-22(32)17-12-27-31-10-4-9-26-21(17)31)20(29-30)16-11-15(7-8-19(16)35-23(24)25)36(33,34)14-5-2-3-6-14;1-11(21)34(31,32)12-4-5-16(33-20(22)23)13(8-12)17-15(10-28(2)27-17)26-19(30)14-9-25-29-7-3-6-24-18(14)29/h4-15,26H,3H2,1-2H3,(H,31,35);3-14,25H,1-2H3,(H,30,34);4,7-14,23H,2-3,5-6H2,1H3,(H,28,32);3-11,20H,1-2H3,(H,26,30).
What are the key properties of N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 2102.08 g/mol, XLogP of 15.28, 29 rotatable bonds, 4 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-cyclopentylsulfonyl-2-(difluoromethoxy)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-ethylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(1-fluoroethylsulfonyl)phenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[2-(difluoromethoxy)-5-(3-methylphenyl)sulfonylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 158878160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).