bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one

C189H322N48O14S5 — CID 160672085

IUPACbis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one
SMILESCC(C)C(=O)N1CCc2c(C(C)C)n[nH]c2C1.CC(C)CC(=O)N1CCc2c(C(C)C)n[nH]c2C1.CC(C)CS(=O)(=O)N1CCc2[nH]nc(C(C)C)c2C1.CC(C)c1n[nH]c2c1CCN(C(=O)C(C)(C)C)C2.CC(C)c1n[nH]c2c1CCN(C(C)(C)C)C2.CC(C)c1n[nH]c2c1CCN(C(C)(C)C)C2.CC(C)c1n[nH]c2c1CCN(C(C)C)C2.CC(C)c1n[nH]c2c1CCN(C)C2.CC(C)c1n[nH]c2c1CCN(S(C)(=O)=O)C2.CC(C)c1n[nH]c2c1CCNC2.CC(C)c1n[nH]c2c1CN(S(=O)(=O)C(C)C)CC2.CC(C)c1n[nH]c2c1CN(S(C)(=O)=O)CC2.CCC(=O)N1CCc2c(C(C)C)n[nH]c2C1.CCCN1CCc2c(C(C)C)n[nH]c2C1.CCN1CCc2c(C(C)C)n[nH]c2C1.CCS(=O)(=O)N1CCc2[nH]nc(C(C)C)c2C1
InChIInChI=1S/2C14H23N3O.C13H23N3O2S.C13H21N3O.2C13H23N3.C12H21N3O2S.C12H19N3O.2C12H21N3.C11H19N3O2S.C11H19N3.2C10H17N3O2S.C10H17N3.C9H15N3/c1-9(2)12-10-6-7-17(8-11(10)15-16-12)13(18)14(3,4)5;1-9(2)7-13(18)17-6-5-11-12(8-17)15-16-14(11)10(3)4;1-9(2)8-19(17,18)16-6-5-12-11(7-16)13(10(3)4)15-14-12;1-8(2)12-10-5-6-16(13(17)9(3)4)7-11(10)14-15-12;2*1-9(2)12-10-6-7-16(13(3,4)5)8-11(10)14-15-12;1-8(2)12-10-7-15(18(16,17)9(3)4)6-5-11(10)13-14-12;1-4-11(16)15-6-5-9-10(7-15)13-14-12(9)8(2)3;1-8(2)12-10-5-6-15(9(3)4)7-11(10)13-14-12;1-4-6-15-7-5-10-11(8-15)13-14-12(10)9(2)3;1-4-17(15,16)14-6-5-10-9(7-14)11(8(2)3)13-12-10;1-4-14-6-5-9-10(7-14)12-13-11(9)8(2)3;1-7(2)10-8-6-13(16(3,14)15)5-4-9(8)11-12-10;1-7(2)10-8-4-5-13(16(3,14)15)6-9(8)11-12-10;1-7(2)10-8-4-5-13(3)6-9(8)11-12-10;1-6(2)9-7-3-4-10-5-8(7)11-12-9/h9H,6-8H2,1-5H3,(H,15,16);9-10H,5-8H2,1-4H3,(H,15,16);9-10H,5-8H2,1-4H3,(H,14,15);8-9H,5-7H2,1-4H3,(H,14,15);2*9H,6-8H2,1-5H3,(H,14,15);8-9H,5-7H2,1-4H3,(H,13,14);8H,4-7H2,1-3H3,(H,13,14);8-9H,5-7H2,1-4H3,(H,13,14);9H,4-8H2,1-3H3,(H,13,14);8H,4-7H2,1-3H3,(H,12,13);8H,4-7H2,1-3H3,(H,12,13);2*7H,4-6H2,1-3H3,(H,11,12);7H,4-6H2,1-3H3,(H,11,12);6,10H,3-5H2,1-2H3,(H,11,12)
InChIKeyRNAZTTVXKVPKSC-UHFFFAOYSA-N
MW3651.31 g/mol
LogP29.87
Rot. Bonds33

About bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one

bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one (PubChem CID 160672085) has the molecular formula C189H322N48O14S5 and a molecular weight of 3651.31 g/mol. Its IUPAC name is bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one.

Molecular Properties

Compound Namebis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one
PubChem CID160672085
Molecular FormulaC189H322N48O14S5
Molecular Weight3651.31 g/mol
Exact Mass3648.46
IUPAC Namebis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one
SMILESCC(C)C(=O)N1CCc2c(C(C)C)n[nH]c2C1.CC(C)CC(=O)N1CCc2c(C(C)C)n[nH]c2C1.CC(C)CS(=O)(=O)N1CCc2[nH]nc(C(C)C)c2C1.CC(C)c1n[nH]c2c1CCN(C(=O)C(C)(C)C)C2.CC(C)c1n[nH]c2c1CCN(C(C)(C)C)C2.CC(C)c1n[nH]c2c1CCN(C(C)(C)C)C2.CC(C)c1n[nH]c2c1CCN(C(C)C)C2.CC(C)c1n[nH]c2c1CCN(C)C2.CC(C)c1n[nH]c2c1CCN(S(C)(=O)=O)C2.CC(C)c1n[nH]c2c1CCNC2.CC(C)c1n[nH]c2c1CN(S(=O)(=O)C(C)C)CC2.CC(C)c1n[nH]c2c1CN(S(C)(=O)=O)CC2.CCC(=O)N1CCc2c(C(C)C)n[nH]c2C1.CCCN1CCc2c(C(C)C)n[nH]c2C1.CCN1CCc2c(C(C)C)n[nH]c2C1.CCS(=O)(=O)N1CCc2[nH]nc(C(C)C)c2C1
InChIInChI=1S/2C14H23N3O.C13H23N3O2S.C13H21N3O.2C13H23N3.C12H21N3O2S.C12H19N3O.2C12H21N3.C11H19N3O2S.C11H19N3.2C10H17N3O2S.C10H17N3.C9H15N3/c1-9(2)12-10-6-7-17(8-11(10)15-16-12)13(18)14(3,4)5;1-9(2)7-13(18)17-6-5-11-12(8-17)15-16-14(11)10(3)4;1-9(2)8-19(17,18)16-6-5-12-11(7-16)13(10(3)4)15-14-12;1-8(2)12-10-5-6-16(13(17)9(3)4)7-11(10)14-15-12;2*1-9(2)12-10-6-7-16(13(3,4)5)8-11(10)14-15-12;1-8(2)12-10-7-15(18(16,17)9(3)4)6-5-11(10)13-14-12;1-4-11(16)15-6-5-9-10(7-15)13-14-12(9)8(2)3;1-8(2)12-10-5-6-15(9(3)4)7-11(10)13-14-12;1-4-6-15-7-5-10-11(8-15)13-14-12(10)9(2)3;1-4-17(15,16)14-6-5-10-9(7-14)11(8(2)3)13-12-10;1-4-14-6-5-9-10(7-14)12-13-11(9)8(2)3;1-7(2)10-8-6-13(16(3,14)15)5-4-9(8)11-12-10;1-7(2)10-8-4-5-13(16(3,14)15)6-9(8)11-12-10;1-7(2)10-8-4-5-13(3)6-9(8)11-12-10;1-6(2)9-7-3-4-10-5-8(7)11-12-9/h9H,6-8H2,1-5H3,(H,15,16);9-10H,5-8H2,1-4H3,(H,15,16);9-10H,5-8H2,1-4H3,(H,14,15);8-9H,5-7H2,1-4H3,(H,14,15);2*9H,6-8H2,1-5H3,(H,14,15);8-9H,5-7H2,1-4H3,(H,13,14);8H,4-7H2,1-3H3,(H,13,14);8-9H,5-7H2,1-4H3,(H,13,14);9H,4-8H2,1-3H3,(H,13,14);8H,4-7H2,1-3H3,(H,12,13);8H,4-7H2,1-3H3,(H,12,13);2*7H,4-6H2,1-3H3,(H,11,12);7H,4-6H2,1-3H3,(H,11,12);6,10H,3-5H2,1-2H3,(H,11,12)
InChIKeyRNAZTTVXKVPKSC-UHFFFAOYSA-N
XLogP29.87
TPSA758.49 Ų
H-Bond Donors17
H-Bond Acceptors37
Rotatable Bonds33
Heavy Atoms256
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003651.31
LogP ≤ 529.87
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1037

Analyze bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one?
The IUPAC name of bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one (CID 160672085) is bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one.
What is the SMILES notation for bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one?
The canonical SMILES for bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one is CC(C)C(=O)N1CCc2c(C(C)C)n[nH]c2C1.CC(C)CC(=O)N1CCc2c(C(C)C)n[nH]c2C1.CC(C)CS(=O)(=O)N1CCc2[nH]nc(C(C)C)c2C1.CC(C)c1n[nH]c2c1CCN(C(=O)C(C)(C)C)C2.CC(C)c1n[nH]c2c1CCN(C(C)(C)C)C2.CC(C)c1n[nH]c2c1CCN(C(C)(C)C)C2.CC(C)c1n[nH]c2c1CCN(C(C)C)C2.CC(C)c1n[nH]c2c1CCN(C)C2.CC(C)c1n[nH]c2c1CCN(S(C)(=O)=O)C2.CC(C)c1n[nH]c2c1CCNC2.CC(C)c1n[nH]c2c1CN(S(=O)(=O)C(C)C)CC2.CC(C)c1n[nH]c2c1CN(S(C)(=O)=O)CC2.CCC(=O)N1CCc2c(C(C)C)n[nH]c2C1.CCCN1CCc2c(C(C)C)n[nH]c2C1.CCN1CCc2c(C(C)C)n[nH]c2C1.CCS(=O)(=O)N1CCc2[nH]nc(C(C)C)c2C1.
What is the InChIKey of bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one?
The InChIKey is RNAZTTVXKVPKSC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H23N3O.C13H23N3O2S.C13H21N3O.2C13H23N3.C12H21N3O2S.C12H19N3O.2C12H21N3.C11H19N3O2S.C11H19N3.2C10H17N3O2S.C10H17N3.C9H15N3/c1-9(2)12-10-6-7-17(8-11(10)15-16-12)13(18)14(3,4)5;1-9(2)7-13(18)17-6-5-11-12(8-17)15-16-14(11)10(3)4;1-9(2)8-19(17,18)16-6-5-12-11(7-16)13(10(3)4)15-14-12;1-8(2)12-10-5-6-16(13(17)9(3)4)7-11(10)14-15-12;2*1-9(2)12-10-6-7-16(13(3,4)5)8-11(10)14-15-12;1-8(2)12-10-7-15(18(16,17)9(3)4)6-5-11(10)13-14-12;1-4-11(16)15-6-5-9-10(7-15)13-14-12(9)8(2)3;1-8(2)12-10-5-6-15(9(3)4)7-11(10)13-14-12;1-4-6-15-7-5-10-11(8-15)13-14-12(10)9(2)3;1-4-17(15,16)14-6-5-10-9(7-14)11(8(2)3)13-12-10;1-4-14-6-5-9-10(7-14)12-13-11(9)8(2)3;1-7(2)10-8-6-13(16(3,14)15)5-4-9(8)11-12-10;1-7(2)10-8-4-5-13(16(3,14)15)6-9(8)11-12-10;1-7(2)10-8-4-5-13(3)6-9(8)11-12-10;1-6(2)9-7-3-4-10-5-8(7)11-12-9/h9H,6-8H2,1-5H3,(H,15,16);9-10H,5-8H2,1-4H3,(H,15,16);9-10H,5-8H2,1-4H3,(H,14,15);8-9H,5-7H2,1-4H3,(H,14,15);2*9H,6-8H2,1-5H3,(H,14,15);8-9H,5-7H2,1-4H3,(H,13,14);8H,4-7H2,1-3H3,(H,13,14);8-9H,5-7H2,1-4H3,(H,13,14);9H,4-8H2,1-3H3,(H,13,14);8H,4-7H2,1-3H3,(H,12,13);8H,4-7H2,1-3H3,(H,12,13);2*7H,4-6H2,1-3H3,(H,11,12);7H,4-6H2,1-3H3,(H,11,12);6,10H,3-5H2,1-2H3,(H,11,12).
What are the key properties of bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one?
bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one has a molecular weight of 3651.31 g/mol, XLogP of 29.87, 33 rotatable bonds, 17 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for bis(6-tert-butyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine);2,2-dimethyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,6-di(propan-2-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;6-ethyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;5-ethylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)butan-1-one;2-methyl-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;5-(2-methylpropylsulfonyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;5-methylsulfonyl-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-methylsulfonyl-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-5-propan-2-ylsulfonyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;3-propan-2-yl-6-propyl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one is sourced from PubChem (CID 160672085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).