5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

C83H93Cl5N30O17 — CID 172989171

IUPAC5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCCOC(=O)c1cc2nc(Cl)cc(Cl)n2n1.CCOC(=O)c1cc2nc(Cl)cc(N3CCOCC3)n2n1.Cc1cccc(/C=N/Nc2cc(N3CCOCC3)n3nc(C(=O)NC4COC4)cc3n2)c1.NNc1cc(N2CCOCC2)n2nc(C(=O)NC3COC3)cc2n1.O=C(NC1COC1)c1cc2nc(Cl)cc(N3CCOCC3)n2n1.O=C(O)c1cc2nc(Cl)cc(N3CCOCC3)n2n1
InChIInChI=1S/C22H25N7O3.C14H16ClN5O3.C14H19N7O3.C13H15ClN4O3.C11H11ClN4O3.C9H7Cl2N3O2/c1-15-3-2-4-16(9-15)12-23-26-19-11-21(28-5-7-31-8-6-28)29-20(25-19)10-18(27-29)22(30)24-17-13-32-14-17;15-11-6-13(19-1-3-22-4-2-19)20-12(17-11)5-10(18-20)14(21)16-9-7-23-8-9;15-18-11-6-13(20-1-3-23-4-2-20)21-12(17-11)5-10(19-21)14(22)16-9-7-24-8-9;1-2-21-13(19)9-7-11-15-10(14)8-12(18(11)16-9)17-3-5-20-6-4-17;12-8-6-10(15-1-3-19-4-2-15)16-9(13-8)5-7(14-16)11(17)18;1-2-16-9(15)5-3-8-12-6(10)4-7(11)14(8)13-5/h2-4,9-12,17H,5-8,13-14H2,1H3,(H,24,30)(H,25,26);5-6,9H,1-4,7-8H2,(H,16,21);5-6,9H,1-4,7-8,15H2,(H,16,22)(H,17,18);7-8H,2-6H2,1H3;5-6H,1-4H2,(H,17,18);3-4H,2H2,1H3/b23-12+;;;;;
InChIKeyMALHHHBMFJXSGK-VYFADUTDSA-N
MW1960.11 g/mol
LogP5.30
Rot. Bonds20

About 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 172989171) has the molecular formula C83H93Cl5N30O17 and a molecular weight of 1960.11 g/mol. Its IUPAC name is 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID172989171
Molecular FormulaC83H93Cl5N30O17
Molecular Weight1960.11 g/mol
Exact Mass1956.58
IUPAC Name5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCCOC(=O)c1cc2nc(Cl)cc(Cl)n2n1.CCOC(=O)c1cc2nc(Cl)cc(N3CCOCC3)n2n1.Cc1cccc(/C=N/Nc2cc(N3CCOCC3)n3nc(C(=O)NC4COC4)cc3n2)c1.NNc1cc(N2CCOCC2)n2nc(C(=O)NC3COC3)cc2n1.O=C(NC1COC1)c1cc2nc(Cl)cc(N3CCOCC3)n2n1.O=C(O)c1cc2nc(Cl)cc(N3CCOCC3)n2n1
InChIInChI=1S/C22H25N7O3.C14H16ClN5O3.C14H19N7O3.C13H15ClN4O3.C11H11ClN4O3.C9H7Cl2N3O2/c1-15-3-2-4-16(9-15)12-23-26-19-11-21(28-5-7-31-8-6-28)29-20(25-19)10-18(27-29)22(30)24-17-13-32-14-17;15-11-6-13(19-1-3-22-4-2-19)20-12(17-11)5-10(18-20)14(21)16-9-7-23-8-9;15-18-11-6-13(20-1-3-23-4-2-20)21-12(17-11)5-10(19-21)14(22)16-9-7-24-8-9;1-2-21-13(19)9-7-11-15-10(14)8-12(18(11)16-9)17-3-5-20-6-4-17;12-8-6-10(15-1-3-19-4-2-15)16-9(13-8)5-7(14-16)11(17)18;1-2-16-9(15)5-3-8-12-6(10)4-7(11)14(8)13-5/h2-4,9-12,17H,5-8,13-14H2,1H3,(H,24,30)(H,25,26);5-6,9H,1-4,7-8H2,(H,16,21);5-6,9H,1-4,7-8,15H2,(H,16,22)(H,17,18);7-8H,2-6H2,1H3;5-6H,1-4H2,(H,17,18);3-4H,2H2,1H3/b23-12+;;;;;
InChIKeyMALHHHBMFJXSGK-VYFADUTDSA-N
XLogP5.30
TPSA510.82 Ų
H-Bond Donors7
H-Bond Acceptors43
Rotatable Bonds20
Heavy Atoms135
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001960.11
LogP ≤ 55.30
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1043

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-(3,3-difluorocyclobutyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;N-(3,3-difluorocyclobutyl)-5-hydrazinyl-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide;N-(3,3-difluorocyclobutyl)-5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 172956882
5-chloro-7-[[(1S)-1-phenylethyl]amino]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 2-[(1R,5S)-3-[5-chloro-7-[2-methylpropyl-[(1S)-1-phenylethyl]amino]pyrazolo[1,5-a]pyrimidine-2-carbonyl]-3-azabicyclo[3.1.0]hexan-6-yl]acetate;ethyl 2-[(1S,5R)-3-[5-chloro-7-[[(1S)-1-phenylethyl]amino]pyrazolo[1,5-a]pyrimidine-2-carbonyl]-3-azabicyclo[3.1.0]hexan-6-yl]acetate;ethyl 5-chloro-7-[[(1S)-1-phenylethyl]amino]pyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 2-[(1S,5R)-3-[7-[2-methylpropyl-[(1S)-1-phenylethyl]amino]-5-(3,4,5-trifluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-3-azabicyclo[3.1.0]hexan-6-yl]acetate
CID 157544609
ethyl 5-chloro-7-[[(2R)-3-methylbutan-2-yl]-(2-methylpropyl)amino]pyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 7-[[(2R)-3-methylbutan-2-yl]-(2-methylpropyl)amino]-5-(3,4,5-trifluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate;iodomethane;7-[[(2R)-3-methylbutan-2-yl]-(2-methylpropyl)amino]-5-(3,4,5-trifluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid;(3R)-3-[methyl-[7-[[(2R)-3-methylbutan-2-yl]-(2-methylpropyl)amino]-5-(3,4,5-trifluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]butanoic acid;methyl (3R)-3-[methyl-[7-[[(2R)-3-methylbutan-2-yl]-(2-methylpropyl)amino]-5-(3,4,5-trifluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]butanoate
CID 157951821
(2R)-N-benzyl-3-methylbutan-2-amine;N-benzyl-2-methyl-N-[(2R)-3-methylbutan-2-yl]propanamide;(2R)-N-benzyl-3-methyl-N-(2-methylpropyl)butan-2-amine;5-chloro-7-[[(2R)-3-methylbutan-2-yl]-(2-methylpropyl)amino]pyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-[[(2R)-3-methylbutan-2-yl]-(2-methylpropyl)amino]pyrazolo[1,5-a]pyrimidine-2-carboxylate;(2R)-3-methylbutan-2-amine;methyl 2-[(1R,5S)-3-[5-chloro-7-[[(2R)-3-methylbutan-2-yl]-(2-methylpropyl)amino]pyrazolo[1,5-a]pyrimidine-2-carbonyl]-3-azabicyclo[3.1.0]hexan-6-yl]acetate;(2R)-3-methyl-N-(2-methylpropyl)butan-2-amine;hydrochloride
CID 158898031
5-(4,4-dimethylcyclohexyl)-7-(N,2,6-trimethylanilino)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-(N,2,6-trimethylanilino)pyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5-(4,4-dimethylcyclohexen-1-yl)-7-(N,2,6-trimethylanilino)pyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 2-[(3R,4S)-1-[5-(4,4-dimethylcyclohexyl)-7-(N,2,6-trimethylanilino)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-3-fluoropiperidin-4-yl]acetate;ethyl 5-(4,4-dimethylcyclohexyl)-7-(N,2,6-trimethylanilino)pyrazolo[1,5-a]pyrimidine-2-carboxylate;methane
CID 160363754
Tert-butyl piperazine-1-carboxylate;3-(2,6-dimethylphenyl)-2-methyl-7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-5-carboxylic acid;3-(2,6-dimethylphenyl)-2-methyl-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid;ethyl 7-chloro-3-(2,6-dimethylphenyl)-2-methylpyrazolo[1,5-a]pyrimidine-5-carboxylate;methane
CID 160669588
lithium;6-chloro-3-hydrazinylpyridazine-4-carboxylic acid;6-chloro-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine-8-carboxylic acid;3,6-dichloropyridazine-4-carboxylic acid;1-ethyl-3-[3-methyl-6-[methyl-[(1S)-1-phenylethyl]amino]-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]urea;hydrazine;methyl 6-chloro-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine-8-carboxylate;methyl 3-methyl-6-[methyl-[(1S)-1-phenylethyl]amino]-[1,2,4]triazolo[4,3-b]pyridazine-8-carboxylate;3-methyl-6-[methyl-[(1S)-1-phenylethyl]amino]-[1,2,4]triazolo[4,3-b]pyridazine-8-carboxylic acid;(1S)-N-methyl-1-phenylethanamine;hydroxide
CID 161499608
ethyl 5-chloro-7-[methyl-[(1S)-1-phenylethyl]amino]pyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 2-[1-[7-[methyl-[(1S)-1-phenylethyl]amino]-5-(3,4,5-trifluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]piperidin-4-yl]acetate;ethyl 7-[methyl-[(1S)-1-phenylethyl]amino]-5-(3,4,5-trifluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate;iodoethane;2-[1-[7-[methyl-[(1S)-1-phenylethyl]amino]-5-(3,4,5-trifluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]piperidin-4-yl]acetic acid;7-[methyl-[(1S)-1-phenylethyl]amino]-5-(3,4,5-trifluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 161760070
ethyl 5-chloro-7-(2,6-dimethylanilino)pyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5-chloro-7-(N,2,6-trimethylanilino)pyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5-(3,4,5-trifluorophenyl)-7-(N,2,6-trimethylanilino)pyrazolo[1,5-a]pyrimidine-2-carboxylate;5-(3,4,5-trifluorophenyl)-7-(N,2,6-trimethylanilino)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 161860151
5-(3-aminophenyl)-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;ethyl 7-chloro-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 7-morpholin-4-yl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5-(3-nitrophenyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylate;7-morpholin-4-yl-5-(3-nitrophenyl)-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;7-morpholin-4-yl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid;7-morpholin-4-yl-N-(oxetan-3-yl)-5-[3-(2-oxopropyl)phenyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 165011807

Frequently Asked Questions

What is the IUPAC name of 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 172989171) is 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is CCOC(=O)c1cc2nc(Cl)cc(Cl)n2n1.CCOC(=O)c1cc2nc(Cl)cc(N3CCOCC3)n2n1.Cc1cccc(/C=N/Nc2cc(N3CCOCC3)n3nc(C(=O)NC4COC4)cc3n2)c1.NNc1cc(N2CCOCC2)n2nc(C(=O)NC3COC3)cc2n1.O=C(NC1COC1)c1cc2nc(Cl)cc(N3CCOCC3)n2n1.O=C(O)c1cc2nc(Cl)cc(N3CCOCC3)n2n1.
What is the InChIKey of 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is MALHHHBMFJXSGK-VYFADUTDSA-N. The full InChI is InChI=1S/C22H25N7O3.C14H16ClN5O3.C14H19N7O3.C13H15ClN4O3.C11H11ClN4O3.C9H7Cl2N3O2/c1-15-3-2-4-16(9-15)12-23-26-19-11-21(28-5-7-31-8-6-28)29-20(25-19)10-18(27-29)22(30)24-17-13-32-14-17;15-11-6-13(19-1-3-22-4-2-19)20-12(17-11)5-10(18-20)14(21)16-9-7-23-8-9;15-18-11-6-13(20-1-3-23-4-2-20)21-12(17-11)5-10(19-21)14(22)16-9-7-24-8-9;1-2-21-13(19)9-7-11-15-10(14)8-12(18(11)16-9)17-3-5-20-6-4-17;12-8-6-10(15-1-3-19-4-2-15)16-9(13-8)5-7(14-16)11(17)18;1-2-16-9(15)5-3-8-12-6(10)4-7(11)14(8)13-5/h2-4,9-12,17H,5-8,13-14H2,1H3,(H,24,30)(H,25,26);5-6,9H,1-4,7-8H2,(H,16,21);5-6,9H,1-4,7-8,15H2,(H,16,22)(H,17,18);7-8H,2-6H2,1H3;5-6H,1-4H2,(H,17,18);3-4H,2H2,1H3/b23-12+;;;;;.
What are the key properties of 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 1960.11 g/mol, XLogP of 5.30, 20 rotatable bonds, 7 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid;ethyl 5-chloro-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxylate;ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylate;5-hydrazinyl-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide;5-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-7-morpholin-4-yl-N-(oxetan-3-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 172989171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).