5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine

C106H123N37OS2 — CID 159147606

IUPAC5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCn1nccc1Nc1cc(C2CCCCC2)nc2c(-c3cnn(C)c3)cnn12.Cc1cc(Nc2cc(C3CCCCC3)nc3c(-c4cnn(C)c4)cnn23)no1.Cc1csc(Nc2cc(C3CCCCC3)nc3c(-c4cnn(C)c4)cnn23)c1.Cn1cc(-c2cnn3c(Nc4ccc(C5=NCCCC5)cn4)cc(C4CCCCC4)nc23)cn1.Cn1cc(-c2cnn3c(Nc4nncs4)cc(C4CCCCC4)nc23)cn1
InChIInChI=1S/C26H30N8.C21H26N8.C21H24N6S.C20H23N7O.C18H20N8S/c1-33-17-20(15-29-33)21-16-30-34-25(13-23(31-26(21)34)18-7-3-2-4-8-18)32-24-11-10-19(14-28-24)22-9-5-6-12-27-22;1-3-28-19(9-10-22-28)26-20-11-18(15-7-5-4-6-8-15)25-21-17(13-24-29(20)21)16-12-23-27(2)14-16;1-14-8-20(28-13-14)25-19-9-18(15-6-4-3-5-7-15)24-21-17(11-23-27(19)21)16-10-22-26(2)12-16;1-13-8-18(25-28-13)24-19-9-17(14-6-4-3-5-7-14)23-20-16(11-22-27(19)20)15-10-21-26(2)12-15;1-25-10-13(8-20-25)14-9-21-26-16(23-18-24-19-11-27-18)7-15(22-17(14)26)12-5-3-2-4-6-12/h10-11,13-18H,2-9,12H2,1H3,(H,28,32);9-15,26H,3-8H2,1-2H3;8-13,15,25H,3-7H2,1-2H3;8-12,14H,3-7H2,1-2H3,(H,24,25);7-12H,2-6H2,1H3,(H,23,24)
InChIKeyKIWOXAKRNGYHBU-UHFFFAOYSA-N
MW1995.54 g/mol
LogP22.71
Rot. Bonds22

About 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine

5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 159147606) has the molecular formula C106H123N37OS2 and a molecular weight of 1995.54 g/mol. Its IUPAC name is 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID159147606
Molecular FormulaC106H123N37OS2
Molecular Weight1995.54 g/mol
Exact Mass1994.02
IUPAC Name5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCn1nccc1Nc1cc(C2CCCCC2)nc2c(-c3cnn(C)c3)cnn12.Cc1cc(Nc2cc(C3CCCCC3)nc3c(-c4cnn(C)c4)cnn23)no1.Cc1csc(Nc2cc(C3CCCCC3)nc3c(-c4cnn(C)c4)cnn23)c1.Cn1cc(-c2cnn3c(Nc4ccc(C5=NCCCC5)cn4)cc(C4CCCCC4)nc23)cn1.Cn1cc(-c2cnn3c(Nc4nncs4)cc(C4CCCCC4)nc23)cn1
InChIInChI=1S/C26H30N8.C21H26N8.C21H24N6S.C20H23N7O.C18H20N8S/c1-33-17-20(15-29-33)21-16-30-34-25(13-23(31-26(21)34)18-7-3-2-4-8-18)32-24-11-10-19(14-28-24)22-9-5-6-12-27-22;1-3-28-19(9-10-22-28)26-20-11-18(15-7-5-4-6-8-15)25-21-17(13-24-29(20)21)16-12-23-27(2)14-16;1-14-8-20(28-13-14)25-19-9-18(15-6-4-3-5-7-15)24-21-17(11-23-27(19)21)16-10-22-26(2)12-16;1-13-8-18(25-28-13)24-19-9-17(14-6-4-3-5-7-14)23-20-16(11-22-27(19)20)15-10-21-26(2)12-15;1-25-10-13(8-20-25)14-9-21-26-16(23-18-24-19-11-27-18)7-15(22-17(14)26)12-5-3-2-4-6-12/h10-11,13-18H,2-9,12H2,1H3,(H,28,32);9-15,26H,3-8H2,1-2H3;8-13,15,25H,3-7H2,1-2H3;8-12,14H,3-7H2,1-2H3,(H,24,25);7-12H,2-6H2,1H3,(H,23,24)
InChIKeyKIWOXAKRNGYHBU-UHFFFAOYSA-N
XLogP22.71
TPSA395.08 Ų
H-Bond Donors5
H-Bond Acceptors40
Rotatable Bonds22
Heavy Atoms146
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001995.54
LogP ≤ 522.71
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1040

Analyze 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine with MolForge

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Launch Full Analysis

Related Compounds

5-methyl-N-[3-[1-methyl-3-[5-[3-(1-methylpyrazol-4-yl)-7-[(4-methylthiophen-2-yl)amino]pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-2-yl]pyrazol-4-yl]-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-1,2-oxazol-3-amine
CID 143439874
2-Tert-butyl-4,5-dimethyl-1,3-thiazole;5-tert-butyl-2-fluoropyridine;3-tert-butyl-5-methyl-1,2-oxazole;3-tert-butyl-6-methylpyridazine;5-tert-butyl-2-methylpyrimidine;2-tert-butyl-4-methyl-1,3-thiazole;3-tert-butyl-1,2-oxazole;5-tert-butyl-1,2-oxazole;3-tert-butylpyridazine;5-tert-butylpyridin-2-amine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;5-tert-butylpyrimidine;5-tert-butyl-1,3,4-thiadiazol-2-amine;2-tert-butyl-1,3,4-thiadiazole;5-tert-butyl-1,3-thiazol-2-amine;2-tert-butyl-1,3-thiazole;methane
CID 157498767
tert-butylbenzene;2-tert-butyl-4H-imidazole;5-tert-butyl-4H-imidazole;2-tert-butyl-1,3,4-oxadiazole;5-tert-butyl-1,2-oxazole;2-tert-butylpyrazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;3-tert-butyl-1H-pyridin-2-one;4-tert-butyl-1H-pyridin-2-one;5-tert-butylpyrimidine;3-tert-butyl-2H-pyrrole;4-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,3-thiazole;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine
CID 157988527
5-methyl-N-[3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-1,2-oxazol-3-amine;3-methyl-N-[5-piperidin-3-yl-3-(1,3-thiazol-5-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;N-[3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-yl-N-[5-(1,4,5,6-tetrahydropyrimidin-2-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 158081547
N-(1,3-benzothiazol-2-yldiazenyl)-1,3-benzothiazol-2-amine;3-[2-(4-carbamoyl-1-methylpyrazol-3-yl)iminohydrazinyl]-1-methylpyrazole-4-carboxamide;4-ethyl-N-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)diazenyl]-5-methyl-1,2,4-triazol-3-amine;5-methyl-N-[(5-methyl-1,2-oxazol-3-yl)diazenyl]-1,2-oxazol-3-amine;6-methyl-N-[(6-methyl-3-pyridinyl)diazenyl]pyridin-3-amine;3-methyl-N-[(3-methyl-1,2,4-thiadiazol-5-yl)diazenyl]-1,2,4-thiadiazol-5-amine;N-(1,2,5-oxadiazol-3-yldiazenyl)-1,2,5-oxadiazol-3-amine;1-phenyl-N-[(1-phenyltetrazol-5-yl)diazenyl]tetrazol-5-amine;N-(pyridin-3-yldiazenyl)pyridin-3-amine;N-(quinolin-3-yldiazenyl)quinolin-3-amine
CID 158101215
N-(5-bromopyrimidin-2-yl)-5-cyclohexyl-3-(1-methylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine
CID 158533552
3,5-dimethyl-4-[phenyl-[4-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-1,2-oxazole;4-[4-[1H-indol-6-yl(phenyl)methyl]piperazin-1-yl]-1-phenylpyrazolo[5,4-d]pyrimidine;4-[4-[(3-methylthiophen-2-yl)-phenylmethyl]piperazin-1-yl]-1-phenylpyrazolo[5,4-d]pyrimidine
CID 158730475
N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-methyl-N-[3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-1,2-oxazol-3-amine;3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;N-[3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine
CID 158893394
butane;butan-2-one;methane;methoxymethane;methyl acetate;2-methyl-1,3-benzothiazole;methylcyclobutane;bis(methylcyclohexane);6-methylimidazo[1,2-b]pyridazine;4-methyl-2-methylidene-1H-pyridine;4-methyl-1,2-oxazole;4-methylpiperidine;2-methylpyridine;bis(3-methylpyridine);4-methylpyridine;4-methylpyrimidine;2-methyl-1H-pyrrole;3-methyl-1H-pyrrole;1-methylpyrrolidine;3-methylpyrrolidine;2-methyl-1,3-thiazole;3-methylthiophene;toluene
CID 160140292
tert-butylbenzene;5-tert-butylimidazo[1,5-a]pyridine;6-tert-butylimidazo[1,5-a]pyridine;7-tert-butylimidazo[1,5-a]pyridine;8-tert-butylimidazo[1,5-a]pyridine;2-tert-butyl-4H-imidazole;5-tert-butyl-4H-imidazole;2-tert-butyl-1,3,4-oxadiazole;5-tert-butyl-1,2-oxazole;2-tert-butylpyrazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;3-tert-butyl-1H-pyridin-2-one;4-tert-butyl-1H-pyridin-2-one;5-tert-butylpyrimidine;3-tert-butyl-2H-pyrrole;4-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,3-thiazole;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;8-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine
CID 160967343
N-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;5-ethylsulfanyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,3,4-thiadiazol-2-amine;5-methyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-oxazol-3-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-4-phenyl-1,3-thiazol-2-amine;3-(1-methylpyrazol-4-yl)-N-(2-phenylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine
CID 161159686
N-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;5-ethylsulfanyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,3,4-thiadiazol-2-amine;5-methyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-oxazol-3-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]isoquinolin-1-amine;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-4-phenyl-1,3-thiazol-2-amine
CID 162023968

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 159147606) is 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine is CCn1nccc1Nc1cc(C2CCCCC2)nc2c(-c3cnn(C)c3)cnn12.Cc1cc(Nc2cc(C3CCCCC3)nc3c(-c4cnn(C)c4)cnn23)no1.Cc1csc(Nc2cc(C3CCCCC3)nc3c(-c4cnn(C)c4)cnn23)c1.Cn1cc(-c2cnn3c(Nc4ccc(C5=NCCCC5)cn4)cc(C4CCCCC4)nc23)cn1.Cn1cc(-c2cnn3c(Nc4nncs4)cc(C4CCCCC4)nc23)cn1.
What is the InChIKey of 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is KIWOXAKRNGYHBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N8.C21H26N8.C21H24N6S.C20H23N7O.C18H20N8S/c1-33-17-20(15-29-33)21-16-30-34-25(13-23(31-26(21)34)18-7-3-2-4-8-18)32-24-11-10-19(14-28-24)22-9-5-6-12-27-22;1-3-28-19(9-10-22-28)26-20-11-18(15-7-5-4-6-8-15)25-21-17(13-24-29(20)21)16-12-23-27(2)14-16;1-14-8-20(28-13-14)25-19-9-18(15-6-4-3-5-7-15)24-21-17(11-23-27(19)21)16-10-22-26(2)12-16;1-13-8-18(25-28-13)24-19-9-17(14-6-4-3-5-7-14)23-20-16(11-22-27(19)20)15-10-21-26(2)12-15;1-25-10-13(8-20-25)14-9-21-26-16(23-18-24-19-11-27-18)7-15(22-17(14)26)12-5-3-2-4-6-12/h10-11,13-18H,2-9,12H2,1H3,(H,28,32);9-15,26H,3-8H2,1-2H3;8-13,15,25H,3-7H2,1-2H3;8-12,14H,3-7H2,1-2H3,(H,24,25);7-12H,2-6H2,1H3,(H,23,24).
What are the key properties of 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine?
5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 1995.54 g/mol, XLogP of 22.71, 22 rotatable bonds, 5 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-N-(2-ethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-(4-methylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-5-methyl-1,2-oxazol-3-amine;N-[5-cyclohexyl-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]-1,3,4-thiadiazol-2-amine;5-cyclohexyl-3-(1-methylpyrazol-4-yl)-N-[5-(2,3,4,5-tetrahydropyridin-6-yl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 159147606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).