7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine

C192H229ClF12N50O7 — CID 160563769

IUPAC7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC(C)c1[nH]nc2c(Cl)cccc12.CC(C)c1[nH]nc2c(F)cccc12.CC(C)c1nn(C(C)C)c2cc(F)ccc12.CC(C)c1nn(C(C)C)c2ccc(F)cc12.CC(C)c1nn(C2COC2)c2cc(F)ccc12.CC(C)c1nnc2cc(C(F)(F)F)ccn12.CC(C)c1nnc2cc(C(N)=O)ccn12.CC(C)c1nnc2ccc(C#N)cn12.CC(C)c1nnc2ccc(C(F)(F)F)cn12.CC(C)c1nnc2ccc(C(N)=O)cn12.CC(C)c1nnc2ccc(F)cn12.CC(C)c1noc2ccccc12.CCOc1ccc2nnc(C(C)C)n2c1.CCn1nc(C(C)C)c2ccc(F)cc21.CNC(=O)c1ccn2c(C(C)C)nnc2c1.COc1ccc2nnc(C(C)C)n2c1.Cc1ccc2nnc(C(C)C)n2c1.Cc1ccn2c(C(C)C)nnc2c1
InChIInChI=1S/C13H15FN2O.2C13H17FN2.C12H15FN2.C11H14N4O.C11H15N3O.C10H11ClN2.2C10H10F3N3.C10H11FN2.2C10H12N4O.C10H10N4.C10H13N3O.2C10H13N3.C10H11NO.C9H10FN3/c1-8(2)13-11-4-3-9(14)5-12(11)16(15-13)10-6-17-7-10;1-8(2)13-11-7-10(14)5-6-12(11)16(15-13)9(3)4;1-8(2)13-11-6-5-10(14)7-12(11)16(15-13)9(3)4;1-4-15-11-7-9(13)5-6-10(11)12(14-15)8(2)3;1-7(2)10-14-13-9-6-8(11(16)12-3)4-5-15(9)10;1-4-15-9-5-6-10-12-13-11(8(2)3)14(10)7-9;1-6(2)9-7-4-3-5-8(11)10(7)13-12-9;1-6(2)9-15-14-8-5-7(10(11,12)13)3-4-16(8)9;1-6(2)9-15-14-8-4-3-7(5-16(8)9)10(11,12)13;1-6(2)9-7-4-3-5-8(11)10(7)13-12-9;1-6(2)10-13-12-8-5-7(9(11)15)3-4-14(8)10;1-6(2)10-13-12-8-4-3-7(9(11)15)5-14(8)10;1-7(2)10-13-12-9-4-3-8(5-11)6-14(9)10;1-7(2)10-12-11-9-5-4-8(14-3)6-13(9)10;1-7(2)10-12-11-9-6-8(3)4-5-13(9)10;1-7(2)10-12-11-9-5-4-8(3)6-13(9)10;1-7(2)10-8-5-3-4-6-9(8)12-11-10;1-6(2)9-12-11-8-4-3-7(10)5-13(8)9/h3-5,8,10H,6-7H2,1-2H3;2*5-9H,1-4H3;5-8H,4H2,1-3H3;4-7H,1-3H3,(H,12,16);5-8H,4H2,1-3H3;3-6H,1-2H3,(H,12,13);2*3-6H,1-2H3;3-6H,1-2H3,(H,12,13);2*3-6H,1-2H3,(H2,11,15);3-4,6-7H,1-2H3;4-7H,1-3H3;2*4-7H,1-3H3;3-7H,1-2H3;3-6H,1-2H3
InChIKeyQZQQQHOYFINDFU-UHFFFAOYSA-N
MW3612.72 g/mol
LogP44.07
Rot. Bonds28

About 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine

7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 160563769) has the molecular formula C192H229ClF12N50O7 and a molecular weight of 3612.72 g/mol. Its IUPAC name is 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID160563769
Molecular FormulaC192H229ClF12N50O7
Molecular Weight3612.72 g/mol
Exact Mass3609.86
IUPAC Name7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC(C)c1[nH]nc2c(Cl)cccc12.CC(C)c1[nH]nc2c(F)cccc12.CC(C)c1nn(C(C)C)c2cc(F)ccc12.CC(C)c1nn(C(C)C)c2ccc(F)cc12.CC(C)c1nn(C2COC2)c2cc(F)ccc12.CC(C)c1nnc2cc(C(F)(F)F)ccn12.CC(C)c1nnc2cc(C(N)=O)ccn12.CC(C)c1nnc2ccc(C#N)cn12.CC(C)c1nnc2ccc(C(F)(F)F)cn12.CC(C)c1nnc2ccc(C(N)=O)cn12.CC(C)c1nnc2ccc(F)cn12.CC(C)c1noc2ccccc12.CCOc1ccc2nnc(C(C)C)n2c1.CCn1nc(C(C)C)c2ccc(F)cc21.CNC(=O)c1ccn2c(C(C)C)nnc2c1.COc1ccc2nnc(C(C)C)n2c1.Cc1ccc2nnc(C(C)C)n2c1.Cc1ccn2c(C(C)C)nnc2c1
InChIInChI=1S/C13H15FN2O.2C13H17FN2.C12H15FN2.C11H14N4O.C11H15N3O.C10H11ClN2.2C10H10F3N3.C10H11FN2.2C10H12N4O.C10H10N4.C10H13N3O.2C10H13N3.C10H11NO.C9H10FN3/c1-8(2)13-11-4-3-9(14)5-12(11)16(15-13)10-6-17-7-10;1-8(2)13-11-7-10(14)5-6-12(11)16(15-13)9(3)4;1-8(2)13-11-6-5-10(14)7-12(11)16(15-13)9(3)4;1-4-15-11-7-9(13)5-6-10(11)12(14-15)8(2)3;1-7(2)10-14-13-9-6-8(11(16)12-3)4-5-15(9)10;1-4-15-9-5-6-10-12-13-11(8(2)3)14(10)7-9;1-6(2)9-7-4-3-5-8(11)10(7)13-12-9;1-6(2)9-15-14-8-5-7(10(11,12)13)3-4-16(8)9;1-6(2)9-15-14-8-4-3-7(5-16(8)9)10(11,12)13;1-6(2)9-7-4-3-5-8(11)10(7)13-12-9;1-6(2)10-13-12-8-5-7(9(11)15)3-4-14(8)10;1-6(2)10-13-12-8-4-3-7(9(11)15)5-14(8)10;1-7(2)10-13-12-9-4-3-8(5-11)6-14(9)10;1-7(2)10-12-11-9-5-4-8(14-3)6-13(9)10;1-7(2)10-12-11-9-6-8(3)4-5-13(9)10;1-7(2)10-12-11-9-5-4-8(3)6-13(9)10;1-7(2)10-8-5-3-4-6-9(8)12-11-10;1-6(2)9-12-11-8-4-3-7(10)5-13(8)9/h3-5,8,10H,6-7H2,1-2H3;2*5-9H,1-4H3;5-8H,4H2,1-3H3;4-7H,1-3H3,(H,12,16);5-8H,4H2,1-3H3;3-6H,1-2H3,(H,12,13);2*3-6H,1-2H3;3-6H,1-2H3,(H,12,13);2*3-6H,1-2H3,(H2,11,15);3-4,6-7H,1-2H3;4-7H,1-3H3;2*4-7H,1-3H3;3-7H,1-2H3;3-6H,1-2H3
InChIKeyQZQQQHOYFINDFU-UHFFFAOYSA-N
XLogP44.07
TPSA653.52 Ų
H-Bond Donors5
H-Bond Acceptors52
Rotatable Bonds28
Heavy Atoms262
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003612.72
LogP ≤ 544.07
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1052

Analyze 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine (CID 160563769) is 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine is CC(C)c1[nH]nc2c(Cl)cccc12.CC(C)c1[nH]nc2c(F)cccc12.CC(C)c1nn(C(C)C)c2cc(F)ccc12.CC(C)c1nn(C(C)C)c2ccc(F)cc12.CC(C)c1nn(C2COC2)c2cc(F)ccc12.CC(C)c1nnc2cc(C(F)(F)F)ccn12.CC(C)c1nnc2cc(C(N)=O)ccn12.CC(C)c1nnc2ccc(C#N)cn12.CC(C)c1nnc2ccc(C(F)(F)F)cn12.CC(C)c1nnc2ccc(C(N)=O)cn12.CC(C)c1nnc2ccc(F)cn12.CC(C)c1noc2ccccc12.CCOc1ccc2nnc(C(C)C)n2c1.CCn1nc(C(C)C)c2ccc(F)cc21.CNC(=O)c1ccn2c(C(C)C)nnc2c1.COc1ccc2nnc(C(C)C)n2c1.Cc1ccc2nnc(C(C)C)n2c1.Cc1ccn2c(C(C)C)nnc2c1.
What is the InChIKey of 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is QZQQQHOYFINDFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2O.2C13H17FN2.C12H15FN2.C11H14N4O.C11H15N3O.C10H11ClN2.2C10H10F3N3.C10H11FN2.2C10H12N4O.C10H10N4.C10H13N3O.2C10H13N3.C10H11NO.C9H10FN3/c1-8(2)13-11-4-3-9(14)5-12(11)16(15-13)10-6-17-7-10;1-8(2)13-11-7-10(14)5-6-12(11)16(15-13)9(3)4;1-8(2)13-11-6-5-10(14)7-12(11)16(15-13)9(3)4;1-4-15-11-7-9(13)5-6-10(11)12(14-15)8(2)3;1-7(2)10-14-13-9-6-8(11(16)12-3)4-5-15(9)10;1-4-15-9-5-6-10-12-13-11(8(2)3)14(10)7-9;1-6(2)9-7-4-3-5-8(11)10(7)13-12-9;1-6(2)9-15-14-8-5-7(10(11,12)13)3-4-16(8)9;1-6(2)9-15-14-8-4-3-7(5-16(8)9)10(11,12)13;1-6(2)9-7-4-3-5-8(11)10(7)13-12-9;1-6(2)10-13-12-8-5-7(9(11)15)3-4-14(8)10;1-6(2)10-13-12-8-4-3-7(9(11)15)5-14(8)10;1-7(2)10-13-12-9-4-3-8(5-11)6-14(9)10;1-7(2)10-12-11-9-5-4-8(14-3)6-13(9)10;1-7(2)10-12-11-9-6-8(3)4-5-13(9)10;1-7(2)10-12-11-9-5-4-8(3)6-13(9)10;1-7(2)10-8-5-3-4-6-9(8)12-11-10;1-6(2)9-12-11-8-4-3-7(10)5-13(8)9/h3-5,8,10H,6-7H2,1-2H3;2*5-9H,1-4H3;5-8H,4H2,1-3H3;4-7H,1-3H3,(H,12,16);5-8H,4H2,1-3H3;3-6H,1-2H3,(H,12,13);2*3-6H,1-2H3;3-6H,1-2H3,(H,12,13);2*3-6H,1-2H3,(H2,11,15);3-4,6-7H,1-2H3;4-7H,1-3H3;2*4-7H,1-3H3;3-7H,1-2H3;3-6H,1-2H3.
What are the key properties of 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine?
7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 3612.72 g/mol, XLogP of 44.07, 28 rotatable bonds, 5 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-propan-2-yl-2H-indazole;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;7-fluoro-3-propan-2-yl-2H-indazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 160563769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).