N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C87H90F6N30O5 — CID 158779443

IUPACN-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNc1cc(Nc2cc(C)cc(C)c2)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(C)cc(C)c2)nc2c(C(N)=O)cnn12.CNc1cc(Nc2cc(C)cc(F)c2)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(F)cc(F)c2F)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(F)ccc2F)nc2c(C(=O)NC3CC3)cnn12
InChIInChI=1S/C19H22N6O.C18H19FN6O.C17H15F3N6O.C17H16F2N6O.C16H18N6O/c1-11-6-12(2)8-14(7-11)22-16-9-17(20-3)25-18(24-16)15(10-21-25)19(26)23-13-4-5-13;1-10-5-11(19)7-13(6-10)22-15-8-16(20-2)25-17(24-15)14(9-21-25)18(26)23-12-3-4-12;1-21-14-6-13(24-12-5-8(18)4-11(19)15(12)20)25-16-10(7-22-26(14)16)17(27)23-9-2-3-9;1-20-15-7-14(23-13-6-9(18)2-5-12(13)19)24-16-11(8-21-25(15)16)17(26)22-10-3-4-10;1-9-4-10(2)6-11(5-9)20-13-7-14(18-3)22-16(21-13)12(8-19-22)15(17)23/h6-10,13,20H,4-5H2,1-3H3,(H,22,24)(H,23,26);5-9,12,20H,3-4H2,1-2H3,(H,22,24)(H,23,26);4-7,9,21H,2-3H2,1H3,(H,23,27)(H,24,25);2,5-8,10,20H,3-4H2,1H3,(H,22,26)(H,23,24);4-8,18H,1-3H3,(H2,17,23)(H,20,21)
InChIKeyIQWOZJCJMYPYEL-UHFFFAOYSA-N
MW1749.87 g/mol
LogP13.62
Rot. Bonds24

About N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 158779443) has the molecular formula C87H90F6N30O5 and a molecular weight of 1749.87 g/mol. Its IUPAC name is N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID158779443
Molecular FormulaC87H90F6N30O5
Molecular Weight1749.87 g/mol
Exact Mass1748.76
IUPAC NameN-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNc1cc(Nc2cc(C)cc(C)c2)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(C)cc(C)c2)nc2c(C(N)=O)cnn12.CNc1cc(Nc2cc(C)cc(F)c2)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(F)cc(F)c2F)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(F)ccc2F)nc2c(C(=O)NC3CC3)cnn12
InChIInChI=1S/C19H22N6O.C18H19FN6O.C17H15F3N6O.C17H16F2N6O.C16H18N6O/c1-11-6-12(2)8-14(7-11)22-16-9-17(20-3)25-18(24-16)15(10-21-25)19(26)23-13-4-5-13;1-10-5-11(19)7-13(6-10)22-15-8-16(20-2)25-17(24-15)14(9-21-25)18(26)23-12-3-4-12;1-21-14-6-13(24-12-5-8(18)4-11(19)15(12)20)25-16-10(7-22-26(14)16)17(27)23-9-2-3-9;1-20-15-7-14(23-13-6-9(18)2-5-12(13)19)24-16-11(8-21-25(15)16)17(26)22-10-3-4-10;1-9-4-10(2)6-11(5-9)20-13-7-14(18-3)22-16(21-13)12(8-19-22)15(17)23/h6-10,13,20H,4-5H2,1-3H3,(H,22,24)(H,23,26);5-9,12,20H,3-4H2,1-2H3,(H,22,24)(H,23,26);4-7,9,21H,2-3H2,1H3,(H,23,27)(H,24,25);2,5-8,10,20H,3-4H2,1H3,(H,22,26)(H,23,24);4-8,18H,1-3H3,(H2,17,23)(H,20,21)
InChIKeyIQWOZJCJMYPYEL-UHFFFAOYSA-N
XLogP13.62
TPSA430.74 Ų
H-Bond Donors15
H-Bond Acceptors30
Rotatable Bonds24
Heavy Atoms128
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001749.87
LogP ≤ 513.62
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Related Compounds

CID 157103917
CID 157103917
N,N-dimethyl-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-[(1-methylpiperidin-4-yl)methyl]-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(2-piperazin-1-ylethyl)-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(piperidin-4-ylmethyl)-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-piperidin-4-yl-4-[[8-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide
CID 157192480
(3E)-3-[[7-(cyclopropylamino)-5-[4-(dimethylamino)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(3E)-3-[[7-(cyclopropylamino)-5-(3-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(3E)-3-[[7-(cyclopropylamino)-5-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(3E)-3-[[7-(cyclopropylamino)-5-[3-(morpholin-4-ylmethyl)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(4E)-4-[[7-(cyclopropylamino)-5-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one
CID 157399172
N-[3-[3-(7H-cyclopenta[b]pyridin-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-5-(trifluoromethyl)phenyl]prop-2-enamide;(E)-4-(dimethylamino)-N-[5-[3-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]but-2-enamide;N-[3-[3-(5-ethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[3-(1-methylpyrazol-4-yl)-5-[3-(5-methyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]prop-2-enamide;N-[3-[3-(2-methyl-4-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-5-(trifluoromethyl)phenyl]prop-2-enamide;N-[3-(3-pyrimidin-4-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)-5-(trifluoromethyl)phenyl]prop-2-enamide
CID 157424870
1-[1-(cyclopropylmethyl)-3-[2-fluoro-3-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(cyclopropylmethyl)-3-[4-fluoro-3-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[3-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[[6-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]-3-pyridinyl]amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
CID 157450309
4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N-(2-phenylethyl)benzamide;4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide;4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 157510763
1-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carbonyl]piperidine-2-carboxamide;3-[1-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carbonyl]piperidin-4-yl]-5-phenyl-1H-imidazol-2-one;[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazin-2-yl]-[2-(1H-pyrazol-5-yl)piperidin-1-yl]methanone;[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazin-2-yl]-(2-pyridin-2-ylpiperidin-1-yl)methanone
CID 157563324
N-cyclopropyl-4-[3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-2-fluorobenzamide;4-[3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-2,6-difluoro-N-methylbenzamide;4-[3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-ethyl-2-fluorobenzamide;4-[3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-2-fluoro-N,N-dimethylbenzamide;4-[3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-2-fluoro-N-methylbenzamide;4-[3-[difluoro-(4-fluoro-2-methylindazol-5-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-2-fluoro-N-propan-2-ylbenzamide
CID 157656021
(1R)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;bis((1R)-N-[4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohexyl]-2,2-difluorocyclopropane-1-carboxamide);bis((1S)-N-[4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohexyl]-2,2-difluorocyclopropane-1-carboxamide)
CID 157686889
N-cyclohexyl-4-[[5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(cyclopropylmethyl)-4-[[5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(2-methyl-4-pyridinyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(piperidin-4-ylmethyl)-4-[[5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide
CID 157817601
(3E)-3-[[7-(cyclopropylamino)-5-[6-(dimethylamino)-3-pyridinyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(3E)-3-[[7-(cyclopropylamino)-5-(3-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(3E)-3-[[7-(cyclopropylamino)-5-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(3E)-3-[[7-(cyclopropylamino)-5-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(3E)-3-[[7-(cyclopropylamino)-5-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one;(4E)-4-[[7-(cyclopropylamino)-5-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]-5-methylidenepyrrolidin-2-one
CID 157841938
1-[1-(cyclopropylmethyl)-3-[2-fluoro-3-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(cyclopropylmethyl)-3-[4-fluoro-3-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(cyclopropylmethyl)-3-[4-methyl-3-(1-methylpyrazol-4-yl)anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[3-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-methyl-3-[[6-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]-3-pyridinyl]amino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
CID 157853516

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 158779443) is N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CNc1cc(Nc2cc(C)cc(C)c2)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(C)cc(C)c2)nc2c(C(N)=O)cnn12.CNc1cc(Nc2cc(C)cc(F)c2)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(F)cc(F)c2F)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(F)ccc2F)nc2c(C(=O)NC3CC3)cnn12.
What is the InChIKey of N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is IQWOZJCJMYPYEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O.C18H19FN6O.C17H15F3N6O.C17H16F2N6O.C16H18N6O/c1-11-6-12(2)8-14(7-11)22-16-9-17(20-3)25-18(24-16)15(10-21-25)19(26)23-13-4-5-13;1-10-5-11(19)7-13(6-10)22-15-8-16(20-2)25-17(24-15)14(9-21-25)18(26)23-12-3-4-12;1-21-14-6-13(24-12-5-8(18)4-11(19)15(12)20)25-16-10(7-22-26(14)16)17(27)23-9-2-3-9;1-20-15-7-14(23-13-6-9(18)2-5-12(13)19)24-16-11(8-21-25(15)16)17(26)22-10-3-4-10;1-9-4-10(2)6-11(5-9)20-13-7-14(18-3)22-16(21-13)12(8-19-22)15(17)23/h6-10,13,20H,4-5H2,1-3H3,(H,22,24)(H,23,26);5-9,12,20H,3-4H2,1-2H3,(H,22,24)(H,23,26);4-7,9,21H,2-3H2,1H3,(H,23,27)(H,24,25);2,5-8,10,20H,3-4H2,1H3,(H,22,26)(H,23,24);4-8,18H,1-3H3,(H2,17,23)(H,20,21).
What are the key properties of N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 1749.87 g/mol, XLogP of 13.62, 24 rotatable bonds, 15 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(2,5-difluoroanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-5-(3-fluoro-5-methylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-cyclopropyl-7-(methylamino)-5-(2,3,5-trifluoroanilino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 158779443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).