5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one

C169H273F3N42O18 — CID 160669195

IUPAC5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one
SMILESCC(C)c1n[nH]c2c1CCN(C1COC1)C2.CC(C)c1n[nH]c2c1CN(C(=O)CC(F)(F)F)CC2.CC(C)c1n[nH]c2c1CN(C1COC1)CCC2.CCC(=O)N1CCCc2[nH]nc(C(C)C)c2C1.CCC(=O)N1CCc2c(C(C)C)n[nH]c2C1.CCC(=O)N1Cc2[nH]nc(C(C)C)c2C1.COCC(=O)N1CCCc2[nH]nc(C(C)C)c2C1.COCC(=O)N1CCc2[nH]nc(C(C)C)c2C1.COCC(=O)N1CCc2c(C(C)C)n[nH]c2C1.COCC(=O)N1Cc2[nH]nc(C(C)C)c2C1.COCCN1CCCc2[nH]nc(C(C)C)c2C1.COCCN1CCc2[nH]nc(C(C)C)c2C1.COCCN1CCc2c(C(C)C)n[nH]c2C1.COCCN1Cc2[nH]nc(C(C)C)c2C1
InChIInChI=1S/C13H21N3O2.C13H21N3O.C13H23N3O.C13H21N3O.C12H16F3N3O.2C12H19N3O2.C12H19N3O.2C12H21N3O.C12H19N3O.C11H17N3O2.C11H19N3O.C11H17N3O/c1-9(2)13-10-7-16(12(17)8-18-3)6-4-5-11(10)14-15-13;1-9(2)13-11-6-16(10-7-17-8-10)5-3-4-12(11)14-15-13;1-10(2)13-11-9-16(7-8-17-3)6-4-5-12(11)14-15-13;1-4-12(17)16-7-5-6-11-10(8-16)13(9(2)3)15-14-11;1-7(2)11-8-6-18(4-3-9(8)16-17-11)10(19)5-12(13,14)15;1-8(2)12-9-6-15(11(16)7-17-3)5-4-10(9)13-14-12;1-8(2)12-9-4-5-15(11(16)7-17-3)6-10(9)13-14-12;1-8(2)12-10-3-4-15(9-6-16-7-9)5-11(10)13-14-12;1-9(2)12-10-8-15(6-7-16-3)5-4-11(10)13-14-12;1-9(2)12-10-4-5-15(6-7-16-3)8-11(10)13-14-12;1-4-11(16)15-6-5-9-10(7-15)13-14-12(9)8(2)3;1-7(2)11-8-4-14(10(15)6-16-3)5-9(8)12-13-11;1-8(2)11-9-6-14(4-5-15-3)7-10(9)12-13-11;1-4-10(15)14-5-8-9(6-14)12-13-11(8)7(2)3/h9H,4-8H2,1-3H3,(H,14,15);9-10H,3-8H2,1-2H3,(H,14,15);10H,4-9H2,1-3H3,(H,14,15);9H,4-8H2,1-3H3,(H,14,15);7H,3-6H2,1-2H3,(H,16,17);2*8H,4-7H2,1-3H3,(H,13,14);8-9H,3-7H2,1-2H3,(H,13,14);2*9H,4-8H2,1-3H3,(H,13,14);8H,4-7H2,1-3H3,(H,13,14);7H,4-6H2,1-3H3,(H,12,13);8H,4-7H2,1-3H3,(H,12,13);7H,4-6H2,1-3H3,(H,12,13)
InChIKeyRMRYVMINFIZTJP-UHFFFAOYSA-N
MW3238.31 g/mol
LogP22.27
Rot. Bonds40

About 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one

5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one (PubChem CID 160669195) has the molecular formula C169H273F3N42O18 and a molecular weight of 3238.31 g/mol. Its IUPAC name is 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one.

Molecular Properties

Compound Name5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one
PubChem CID160669195
Molecular FormulaC169H273F3N42O18
Molecular Weight3238.31 g/mol
Exact Mass3236.17
IUPAC Name5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one
SMILESCC(C)c1n[nH]c2c1CCN(C1COC1)C2.CC(C)c1n[nH]c2c1CN(C(=O)CC(F)(F)F)CC2.CC(C)c1n[nH]c2c1CN(C1COC1)CCC2.CCC(=O)N1CCCc2[nH]nc(C(C)C)c2C1.CCC(=O)N1CCc2c(C(C)C)n[nH]c2C1.CCC(=O)N1Cc2[nH]nc(C(C)C)c2C1.COCC(=O)N1CCCc2[nH]nc(C(C)C)c2C1.COCC(=O)N1CCc2[nH]nc(C(C)C)c2C1.COCC(=O)N1CCc2c(C(C)C)n[nH]c2C1.COCC(=O)N1Cc2[nH]nc(C(C)C)c2C1.COCCN1CCCc2[nH]nc(C(C)C)c2C1.COCCN1CCc2[nH]nc(C(C)C)c2C1.COCCN1CCc2c(C(C)C)n[nH]c2C1.COCCN1Cc2[nH]nc(C(C)C)c2C1
InChIInChI=1S/C13H21N3O2.C13H21N3O.C13H23N3O.C13H21N3O.C12H16F3N3O.2C12H19N3O2.C12H19N3O.2C12H21N3O.C12H19N3O.C11H17N3O2.C11H19N3O.C11H17N3O/c1-9(2)13-10-7-16(12(17)8-18-3)6-4-5-11(10)14-15-13;1-9(2)13-11-6-16(10-7-17-8-10)5-3-4-12(11)14-15-13;1-10(2)13-11-9-16(7-8-17-3)6-4-5-12(11)14-15-13;1-4-12(17)16-7-5-6-11-10(8-16)13(9(2)3)15-14-11;1-7(2)11-8-6-18(4-3-9(8)16-17-11)10(19)5-12(13,14)15;1-8(2)12-9-6-15(11(16)7-17-3)5-4-10(9)13-14-12;1-8(2)12-9-4-5-15(11(16)7-17-3)6-10(9)13-14-12;1-8(2)12-10-3-4-15(9-6-16-7-9)5-11(10)13-14-12;1-9(2)12-10-8-15(6-7-16-3)5-4-11(10)13-14-12;1-9(2)12-10-4-5-15(6-7-16-3)8-11(10)13-14-12;1-4-11(16)15-6-5-9-10(7-15)13-14-12(9)8(2)3;1-7(2)11-8-4-14(10(15)6-16-3)5-9(8)12-13-11;1-8(2)11-9-6-14(4-5-15-3)7-10(9)12-13-11;1-4-10(15)14-5-8-9(6-14)12-13-11(8)7(2)3/h9H,4-8H2,1-3H3,(H,14,15);9-10H,3-8H2,1-2H3,(H,14,15);10H,4-9H2,1-3H3,(H,14,15);9H,4-8H2,1-3H3,(H,14,15);7H,3-6H2,1-2H3,(H,16,17);2*8H,4-7H2,1-3H3,(H,13,14);8-9H,3-7H2,1-2H3,(H,13,14);2*9H,4-8H2,1-3H3,(H,13,14);8H,4-7H2,1-3H3,(H,13,14);7H,4-6H2,1-3H3,(H,12,13);8H,4-7H2,1-3H3,(H,12,13);7H,4-6H2,1-3H3,(H,12,13)
InChIKeyRMRYVMINFIZTJP-UHFFFAOYSA-N
XLogP22.27
TPSA675.74 Ų
H-Bond Donors14
H-Bond Acceptors38
Rotatable Bonds40
Heavy Atoms232
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003238.31
LogP ≤ 522.27
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1038

Analyze 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one with MolForge

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What is the IUPAC name of 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one?
The IUPAC name of 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one (CID 160669195) is 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one.
What is the SMILES notation for 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one?
The canonical SMILES for 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one is CC(C)c1n[nH]c2c1CCN(C1COC1)C2.CC(C)c1n[nH]c2c1CN(C(=O)CC(F)(F)F)CC2.CC(C)c1n[nH]c2c1CN(C1COC1)CCC2.CCC(=O)N1CCCc2[nH]nc(C(C)C)c2C1.CCC(=O)N1CCc2c(C(C)C)n[nH]c2C1.CCC(=O)N1Cc2[nH]nc(C(C)C)c2C1.COCC(=O)N1CCCc2[nH]nc(C(C)C)c2C1.COCC(=O)N1CCc2[nH]nc(C(C)C)c2C1.COCC(=O)N1CCc2c(C(C)C)n[nH]c2C1.COCC(=O)N1Cc2[nH]nc(C(C)C)c2C1.COCCN1CCCc2[nH]nc(C(C)C)c2C1.COCCN1CCc2[nH]nc(C(C)C)c2C1.COCCN1CCc2c(C(C)C)n[nH]c2C1.COCCN1Cc2[nH]nc(C(C)C)c2C1.
What is the InChIKey of 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one?
The InChIKey is RMRYVMINFIZTJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2.C13H21N3O.C13H23N3O.C13H21N3O.C12H16F3N3O.2C12H19N3O2.C12H19N3O.2C12H21N3O.C12H19N3O.C11H17N3O2.C11H19N3O.C11H17N3O/c1-9(2)13-10-7-16(12(17)8-18-3)6-4-5-11(10)14-15-13;1-9(2)13-11-6-16(10-7-17-8-10)5-3-4-12(11)14-15-13;1-10(2)13-11-9-16(7-8-17-3)6-4-5-12(11)14-15-13;1-4-12(17)16-7-5-6-11-10(8-16)13(9(2)3)15-14-11;1-7(2)11-8-6-18(4-3-9(8)16-17-11)10(19)5-12(13,14)15;1-8(2)12-9-6-15(11(16)7-17-3)5-4-10(9)13-14-12;1-8(2)12-9-4-5-15(11(16)7-17-3)6-10(9)13-14-12;1-8(2)12-10-3-4-15(9-6-16-7-9)5-11(10)13-14-12;1-9(2)12-10-8-15(6-7-16-3)5-4-11(10)13-14-12;1-9(2)12-10-4-5-15(6-7-16-3)8-11(10)13-14-12;1-4-11(16)15-6-5-9-10(7-15)13-14-12(9)8(2)3;1-7(2)11-8-4-14(10(15)6-16-3)5-9(8)12-13-11;1-8(2)11-9-6-14(4-5-15-3)7-10(9)12-13-11;1-4-10(15)14-5-8-9(6-14)12-13-11(8)7(2)3/h9H,4-8H2,1-3H3,(H,14,15);9-10H,3-8H2,1-2H3,(H,14,15);10H,4-9H2,1-3H3,(H,14,15);9H,4-8H2,1-3H3,(H,14,15);7H,3-6H2,1-2H3,(H,16,17);2*8H,4-7H2,1-3H3,(H,13,14);8-9H,3-7H2,1-2H3,(H,13,14);2*9H,4-8H2,1-3H3,(H,13,14);8H,4-7H2,1-3H3,(H,13,14);7H,4-6H2,1-3H3,(H,12,13);8H,4-7H2,1-3H3,(H,12,13);7H,4-6H2,1-3H3,(H,12,13).
What are the key properties of 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one?
5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one has a molecular weight of 3238.31 g/mol, XLogP of 22.27, 40 rotatable bonds, 14 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole;5-(2-methoxyethyl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;5-(2-methoxyethyl)-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine;6-(2-methoxyethyl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;2-methoxy-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)ethanone;2-methoxy-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)ethanone;5-(oxetan-3-yl)-3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepine;6-(oxetan-3-yl)-3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)propan-1-one;1-(3-propan-2-yl-4,6,7,8-tetrahydro-1H-pyrazolo[4,3-c]azepin-5-yl)propan-1-one;1-(3-propan-2-yl-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-6-yl)propan-1-one;3,3,3-trifluoro-1-(3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)propan-1-one is sourced from PubChem (CID 160669195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).