N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C69H51Cl3F6N24O9 — CID 157113206

IUPACN-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCN1CCC(n2cc(NC(=O)c3cnn4cccnc34)c(-c3cc(Cl)c(C#N)cc3OC(F)F)n2)C1=O.CN1CC[C@@H](n2cc(NC(=O)c3cnn4cccnc34)c(-c3cc(Cl)c(C#N)cc3OC(F)F)n2)C1=O.CN1CC[C@H](n2cc(NC(=O)c3cnn4cccnc34)c(-c3cc(Cl)c(C#N)cc3OC(F)F)n2)C1=O
InChIInChI=1S/3C23H17ClF2N8O3/c3*1-32-6-3-17(22(32)36)34-11-16(30-21(35)14-10-29-33-5-2-4-28-20(14)33)19(31-34)13-8-15(24)12(9-27)7-18(13)37-23(25)26/h3*2,4-5,7-8,10-11,17,23H,3,6H2,1H3,(H,30,35)/t2*17-;/m10./s1
InChIKeyAHBZEBKPDJOUCA-PUTKXPNSSA-N
MW1580.67 g/mol
LogP10.12
Rot. Bonds18

About N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 157113206) has the molecular formula C69H51Cl3F6N24O9 and a molecular weight of 1580.67 g/mol. Its IUPAC name is N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID157113206
Molecular FormulaC69H51Cl3F6N24O9
Molecular Weight1580.67 g/mol
Exact Mass1578.32
IUPAC NameN-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCN1CCC(n2cc(NC(=O)c3cnn4cccnc34)c(-c3cc(Cl)c(C#N)cc3OC(F)F)n2)C1=O.CN1CC[C@@H](n2cc(NC(=O)c3cnn4cccnc34)c(-c3cc(Cl)c(C#N)cc3OC(F)F)n2)C1=O.CN1CC[C@H](n2cc(NC(=O)c3cnn4cccnc34)c(-c3cc(Cl)c(C#N)cc3OC(F)F)n2)C1=O
InChIInChI=1S/3C23H17ClF2N8O3/c3*1-32-6-3-17(22(32)36)34-11-16(30-21(35)14-10-29-33-5-2-4-28-20(14)33)19(31-34)13-8-15(24)12(9-27)7-18(13)37-23(25)26/h3*2,4-5,7-8,10-11,17,23H,3,6H2,1H3,(H,30,35)/t2*17-;/m10./s1
InChIKeyAHBZEBKPDJOUCA-PUTKXPNSSA-N
XLogP10.12
TPSA391.32 Ų
H-Bond Donors3
H-Bond Acceptors27
Rotatable Bonds18
Heavy Atoms111
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001580.67
LogP ≤ 510.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1027

Analyze N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Related Compounds

N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;ethane
CID 142622308
N-[3-[6-(difluoromethoxy)-3,4-dihydro-2H-1,4-benzothiazin-7-yl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 142622294
N-[3-[6-(difluoromethoxy)-3,4-dihydro-2H-1,4-benzothiazin-7-yl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 142622298
N-[3-[5-chloro-2-(difluoromethoxy)phenyl]-1-[(3R)-1-[2-(4-methylpiperazin-1-yl)ethyl]-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 155245700
N-[3-[2-(difluoromethoxy)-5-(difluoromethylsulfanyl)phenyl]-1-[(3R)-2-oxooxolan-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 142622261
(3R,4R)-3-[3-[5-chloro-2-(difluoromethoxy)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]-4-hydroxypiperidine-1-carboxylic acid
CID 118523148
N-[3-[6-(difluoromethoxy)-3-oxo-4H-1,4-benzoxazin-7-yl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 135197200
N-[3-[5-chloro-2-(difluoromethoxy)phenyl]-1-[(3R,4R)-3-hydroxypiperidin-4-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 118522529
(3S,4S)-4-[3-[5-chloro-2-(difluoromethoxy)phenyl]-4-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)pyrazol-1-yl]-3-hydroxypiperidine-1-carboxylate
CID 154317308
N-[3-[3-(difluoromethoxy)naphthalen-2-yl]-1-[(1-methylpiperidin-4-yl)methyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 135200202
N-[3-[2-(difluoromethoxy)-5-methylsulfanylphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129178158
N-[3-[2-(difluoromethoxy)-5-[1-[(3S)-1-methylpyrrolidin-3-yl]pyrazol-4-yl]oxyphenyl]-1-methylpyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 164729976

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 157113206) is N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is CN1CCC(n2cc(NC(=O)c3cnn4cccnc34)c(-c3cc(Cl)c(C#N)cc3OC(F)F)n2)C1=O.CN1CC[C@@H](n2cc(NC(=O)c3cnn4cccnc34)c(-c3cc(Cl)c(C#N)cc3OC(F)F)n2)C1=O.CN1CC[C@H](n2cc(NC(=O)c3cnn4cccnc34)c(-c3cc(Cl)c(C#N)cc3OC(F)F)n2)C1=O.
What is the InChIKey of N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is AHBZEBKPDJOUCA-PUTKXPNSSA-N. The full InChI is InChI=1S/3C23H17ClF2N8O3/c3*1-32-6-3-17(22(32)36)34-11-16(30-21(35)14-10-29-33-5-2-4-28-20(14)33)19(31-34)13-8-15(24)12(9-27)7-18(13)37-23(25)26/h3*2,4-5,7-8,10-11,17,23H,3,6H2,1H3,(H,30,35)/t2*17-;/m10./s1.
What are the key properties of N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 1580.67 g/mol, XLogP of 10.12, 18 rotatable bonds, 3 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-(1-methyl-2-oxopyrrolidin-3-yl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-[5-chloro-4-cyano-2-(difluoromethoxy)phenyl]-1-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 157113206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).