5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane

C170H233N43 — CID 158066630

IUPAC5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane
SMILESC.CC(C)(C)c1cc2ncccn2n1.CC(C)(C)c1cccc2ncnn12.CC(C)(C)c1ccn2nccc2n1.CC(C)(C)c1ccn2ncnc2c1.CC(C)(C)c1cnn2ccccc12.CC(C)(C)c1cnn2cccnc12.CC(C)(C)c1cnn2ccncc12.Cc1cc(C(C)(C)C)n2nc(C)c(C)c2n1.Cc1cc(C(C)(C)C)nc2ccnn12.Cc1cc2nc(C(C)(C)C)cc(C)n2n1.Cc1cc2nc(C(C)(C)C)cc(C3CC3)n2n1.Cc1cnc2c(C(C)(C)C)cnn2c1.Cc1cnn2c(C(C)(C)C)cc(C(C)C)nc12.Cc1nn2ccccc2c1C(C)(C)C.Cc1nn2cccnc2c1C(C)(C)C
InChIInChI=1S/C14H19N3.C14H21N3.C13H19N3.C12H17N3.C12H16N2.3C11H15N3.C11H14N2.6C10H13N3.CH4/c1-9-7-13-15-12(14(2,3)4)8-11(10-5-6-10)17(13)16-9;1-9(2)11-7-12(14(4,5)6)17-13(16-11)10(3)8-15-17;1-8-7-11(13(4,5)6)16-12(14-8)9(2)10(3)15-16;1-8-6-11-13-10(12(3,4)5)7-9(2)15(11)14-8;1-9-11(12(2,3)4)10-7-5-6-8-14(10)13-9;1-8-5-12-10-9(11(2,3)4)6-13-14(10)7-8;1-8-7-9(11(2,3)4)13-10-5-6-12-14(8)10;1-8-9(11(2,3)4)10-12-6-5-7-14(10)13-8;1-11(2,3)9-8-12-13-7-5-4-6-10(9)13;1-10(2,3)8-5-7-13-9(12-8)4-6-11-13;1-10(2,3)8-6-12-13-5-4-11-7-9(8)13;1-10(2,3)8-4-5-13-9(6-8)11-7-12-13;1-10(2,3)8-7-12-13-6-4-5-11-9(8)13;1-10(2,3)8-7-9-11-5-4-6-13(9)12-8;1-10(2,3)8-5-4-6-9-11-7-12-13(8)9;/h7-8,10H,5-6H2,1-4H3;7-9H,1-6H3;7H,1-6H3;6-7H,1-5H3;5-8H,1-4H3;3*5-7H,1-4H3;4-8H,1-3H3;6*4-7H,1-3H3;1H4
InChIKeyFLHQNXLBMBXOBJ-UHFFFAOYSA-N
MW2879.03 g/mol
LogP37.64
Rot. Bonds2

About 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane

5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane (PubChem CID 158066630) has the molecular formula C170H233N43 and a molecular weight of 2879.03 g/mol. Its IUPAC name is 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane.

Molecular Properties

Compound Name5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane
PubChem CID158066630
Molecular FormulaC170H233N43
Molecular Weight2879.03 g/mol
Exact Mass2876.96
IUPAC Name5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane
SMILESC.CC(C)(C)c1cc2ncccn2n1.CC(C)(C)c1cccc2ncnn12.CC(C)(C)c1ccn2nccc2n1.CC(C)(C)c1ccn2ncnc2c1.CC(C)(C)c1cnn2ccccc12.CC(C)(C)c1cnn2cccnc12.CC(C)(C)c1cnn2ccncc12.Cc1cc(C(C)(C)C)n2nc(C)c(C)c2n1.Cc1cc(C(C)(C)C)nc2ccnn12.Cc1cc2nc(C(C)(C)C)cc(C)n2n1.Cc1cc2nc(C(C)(C)C)cc(C3CC3)n2n1.Cc1cnc2c(C(C)(C)C)cnn2c1.Cc1cnn2c(C(C)(C)C)cc(C(C)C)nc12.Cc1nn2ccccc2c1C(C)(C)C.Cc1nn2cccnc2c1C(C)(C)C
InChIInChI=1S/C14H19N3.C14H21N3.C13H19N3.C12H17N3.C12H16N2.3C11H15N3.C11H14N2.6C10H13N3.CH4/c1-9-7-13-15-12(14(2,3)4)8-11(10-5-6-10)17(13)16-9;1-9(2)11-7-12(14(4,5)6)17-13(16-11)10(3)8-15-17;1-8-7-11(13(4,5)6)16-12(14-8)9(2)10(3)15-16;1-8-6-11-13-10(12(3,4)5)7-9(2)15(11)14-8;1-9-11(12(2,3)4)10-7-5-6-8-14(10)13-9;1-8-5-12-10-9(11(2,3)4)6-13-14(10)7-8;1-8-7-9(11(2,3)4)13-10-5-6-12-14(8)10;1-8-9(11(2,3)4)10-12-6-5-7-14(10)13-8;1-11(2,3)9-8-12-13-7-5-4-6-10(9)13;1-10(2,3)8-5-7-13-9(12-8)4-6-11-13;1-10(2,3)8-6-12-13-5-4-11-7-9(8)13;1-10(2,3)8-4-5-13-9(6-8)11-7-12-13;1-10(2,3)8-7-12-13-6-4-5-11-9(8)13;1-10(2,3)8-7-9-11-5-4-6-13(9)12-8;1-10(2,3)8-5-4-6-9-11-7-12-13(8)9;/h7-8,10H,5-6H2,1-4H3;7-9H,1-6H3;7H,1-6H3;6-7H,1-5H3;5-8H,1-4H3;3*5-7H,1-4H3;4-8H,1-3H3;6*4-7H,1-3H3;1H4
InChIKeyFLHQNXLBMBXOBJ-UHFFFAOYSA-N
XLogP37.64
TPSA427.07 Ų
H-Bond Donors
H-Bond Acceptors43
Rotatable Bonds2
Heavy Atoms213
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002879.03
LogP ≤ 537.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1043

Analyze 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane with MolForge

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Launch Full Analysis

Related Compounds

5-(1-Methylpyrazol-4-yl)-3-(pyrazolo[1,5-a]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine
CID 68353953
4-[4-[5-[(4-Fluorophenyl)methyl]pyrimidin-2-yl]piperazin-1-yl]-6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazine
CID 118032848
4-[4-[5-[2-(4-Fluorophenyl)propan-2-yl]pyrimidin-2-yl]piperazin-1-yl]-6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazine
CID 118032872
3-Indazol-1-yl-5-[1-methyl-5-(1-phenylcyclopropyl)-1,2,4-triazol-3-yl]pyrazin-2-amine
CID 137637244
5,8-Dimethyl-2-(2-phenylpyrazolo[1,5-a]pyridin-6-yl)-[1,2,4]triazolo[1,5-a]pyrazine
CID 145972948
5-[2-(1-Methylpiperidin-4-yl)pyrazol-3-yl]-7-pyridin-3-ylpyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 155534643
US9266891, III-9
CID 76071897
4-[4-[5-[1-(4-Fluorophenyl)ethenyl]pyrimidin-2-yl]piperazin-1-yl]-6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazine
CID 118032856
4-[4-[5-[(1R)-1-(4-fluorophenyl)propyl]pyrimidin-2-yl]piperazin-1-yl]-6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazine
CID 118032874
4-[4-[5-[(1S)-1-(4-fluorophenyl)propyl]pyrimidin-2-yl]piperazin-1-yl]-6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazine
CID 118032876
4-[4-[5-[2-(4-Fluorophenyl)propan-2-yl]pyrimidin-2-yl]piperazin-1-yl]-7-(1-methylpyrazol-4-yl)pyrazolo[1,5-a][1,3,5]triazine
CID 118032878
6-(1-Methylpyrazol-4-yl)-4-[4-[5-[2-(2,4,6-trifluorophenyl)propan-2-yl]pyrimidin-2-yl]piperazin-1-yl]pyrrolo[2,1-f][1,2,4]triazine
CID 118032941

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane?
The IUPAC name of 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane (CID 158066630) is 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane.
What is the SMILES notation for 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane?
The canonical SMILES for 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane is C.CC(C)(C)c1cc2ncccn2n1.CC(C)(C)c1cccc2ncnn12.CC(C)(C)c1ccn2nccc2n1.CC(C)(C)c1ccn2ncnc2c1.CC(C)(C)c1cnn2ccccc12.CC(C)(C)c1cnn2cccnc12.CC(C)(C)c1cnn2ccncc12.Cc1cc(C(C)(C)C)n2nc(C)c(C)c2n1.Cc1cc(C(C)(C)C)nc2ccnn12.Cc1cc2nc(C(C)(C)C)cc(C)n2n1.Cc1cc2nc(C(C)(C)C)cc(C3CC3)n2n1.Cc1cnc2c(C(C)(C)C)cnn2c1.Cc1cnn2c(C(C)(C)C)cc(C(C)C)nc12.Cc1nn2ccccc2c1C(C)(C)C.Cc1nn2cccnc2c1C(C)(C)C.
What is the InChIKey of 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane?
The InChIKey is FLHQNXLBMBXOBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3.C14H21N3.C13H19N3.C12H17N3.C12H16N2.3C11H15N3.C11H14N2.6C10H13N3.CH4/c1-9-7-13-15-12(14(2,3)4)8-11(10-5-6-10)17(13)16-9;1-9(2)11-7-12(14(4,5)6)17-13(16-11)10(3)8-15-17;1-8-7-11(13(4,5)6)16-12(14-8)9(2)10(3)15-16;1-8-6-11-13-10(12(3,4)5)7-9(2)15(11)14-8;1-9-11(12(2,3)4)10-7-5-6-8-14(10)13-9;1-8-5-12-10-9(11(2,3)4)6-13-14(10)7-8;1-8-7-9(11(2,3)4)13-10-5-6-12-14(8)10;1-8-9(11(2,3)4)10-12-6-5-7-14(10)13-8;1-11(2,3)9-8-12-13-7-5-4-6-10(9)13;1-10(2,3)8-5-7-13-9(12-8)4-6-11-13;1-10(2,3)8-6-12-13-5-4-11-7-9(8)13;1-10(2,3)8-4-5-13-9(6-8)11-7-12-13;1-10(2,3)8-7-12-13-6-4-5-11-9(8)13;1-10(2,3)8-7-9-11-5-4-6-13(9)12-8;1-10(2,3)8-5-4-6-9-11-7-12-13(8)9;/h7-8,10H,5-6H2,1-4H3;7-9H,1-6H3;7H,1-6H3;6-7H,1-5H3;5-8H,1-4H3;3*5-7H,1-4H3;4-8H,1-3H3;6*4-7H,1-3H3;1H4.
What are the key properties of 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane?
5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane has a molecular weight of 2879.03 g/mol, XLogP of 37.64, 2 rotatable bonds, 0 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-7-cyclopropyl-2-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2,7-dimethylpyrazolo[1,5-a]pyrimidine;7-tert-butyl-3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyridine;3-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine;3-tert-butyl-6-methylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrazine;3-tert-butylpyrazolo[1,5-a]pyridine;2-tert-butylpyrazolo[1,5-a]pyrimidine;3-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine;7-tert-butyl-2,3,5-trimethylpyrazolo[1,5-a]pyrimidine;methane is sourced from PubChem (CID 158066630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).