3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide

C161H192Cl3F33N36O11S2 — CID 158127227

IUPAC3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide
SMILESCC(=O)Nc1ncc(C(C)C)cc1C(F)(F)F.CC(C)c1cnc(-n2cccn2)c(C(F)(F)F)c1.CC(C)c1cnc(-n2ccnn2)c(C(F)(F)F)c1.CC(C)c1cnc(-n2cnnn2)c(C(F)(F)F)c1.CC(C)c1cnc(-n2nccn2)c(C(F)(F)F)c1.CC(C)c1cnc(N2CCCS2(=O)=O)c(C(F)(F)F)c1.CC(C)c1cnc(Nc2nccs2)c(C(F)(F)F)c1.CCC(C)COc1ncc(C(C)C)cc1C(F)(F)F.COCC(C)N(C)c1ncc(C(C)C)cc1C(F)(F)F.COCc1ncc(C(C)C)cc1C(F)(F)F.COc1nc(-n2cccn2)c(Cl)cc1C(C)C.COc1nc(-n2nccn2)c(Cl)cc1C(C)C.COc1nc(OC)c(C(C)C)cc1Cl.COc1ncc(C(C)C)cc1C(F)(F)F
InChIInChI=1S/C14H21F3N2O.C14H20F3NO.C12H14ClN3O.C12H12F3N3S.C12H12F3N3.C12H15F3N2O2S.C11H13ClN4O.2C11H11F3N4.C11H13F3N2O.C11H14F3NO.C10H14ClNO2.C10H10F3N5.C10H12F3NO/c1-9(2)11-6-12(14(15,16)17)13(18-7-11)19(4)10(3)8-20-5;1-5-10(4)8-19-13-12(14(15,16)17)6-11(7-18-13)9(2)3;1-8(2)9-7-10(13)11(15-12(9)17-3)16-6-4-5-14-16;1-7(2)8-5-9(12(13,14)15)10(17-6-8)18-11-16-3-4-19-11;1-8(2)9-6-10(12(13,14)15)11(16-7-9)18-5-3-4-17-18;1-8(2)9-6-10(12(13,14)15)11(16-7-9)17-4-3-5-20(17,18)19;1-7(2)8-6-9(12)10(15-11(8)17-3)16-13-4-5-14-16;1-7(2)8-5-9(11(12,13)14)10(15-6-8)18-4-3-16-17-18;1-7(2)8-5-9(11(12,13)14)10(15-6-8)18-16-3-4-17-18;1-6(2)8-4-9(11(12,13)14)10(15-5-8)16-7(3)17;1-7(2)8-4-9(11(12,13)14)10(6-16-3)15-5-8;1-6(2)7-5-8(11)10(14-4)12-9(7)13-3;1-6(2)7-3-8(10(11,12)13)9(14-4-7)18-5-15-16-17-18;1-6(2)7-4-8(10(11,12)13)9(15-3)14-5-7/h6-7,9-10H,8H2,1-5H3;6-7,9-10H,5,8H2,1-4H3;4-8H,1-3H3;3-7H,1-2H3,(H,16,17,18);3-8H,1-2H3;6-8H,3-5H2,1-2H3;4-7H,1-3H3;2*3-7H,1-2H3;4-6H,1-3H3,(H,15,16,17);4-5,7H,6H2,1-3H3;5-6H,1-4H3;3-6H,1-2H3;4-6H,1-3H3
InChIKeyFSIIHSANOPIAMQ-UHFFFAOYSA-N
MW3604.97 g/mol
LogP44.91
Rot. Bonds39

About 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide

3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide (PubChem CID 158127227) has the molecular formula C161H192Cl3F33N36O11S2 and a molecular weight of 3604.97 g/mol. Its IUPAC name is 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide.

Molecular Properties

Compound Name3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide
PubChem CID158127227
Molecular FormulaC161H192Cl3F33N36O11S2
Molecular Weight3604.97 g/mol
Exact Mass3601.36
IUPAC Name3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide
SMILESCC(=O)Nc1ncc(C(C)C)cc1C(F)(F)F.CC(C)c1cnc(-n2cccn2)c(C(F)(F)F)c1.CC(C)c1cnc(-n2ccnn2)c(C(F)(F)F)c1.CC(C)c1cnc(-n2cnnn2)c(C(F)(F)F)c1.CC(C)c1cnc(-n2nccn2)c(C(F)(F)F)c1.CC(C)c1cnc(N2CCCS2(=O)=O)c(C(F)(F)F)c1.CC(C)c1cnc(Nc2nccs2)c(C(F)(F)F)c1.CCC(C)COc1ncc(C(C)C)cc1C(F)(F)F.COCC(C)N(C)c1ncc(C(C)C)cc1C(F)(F)F.COCc1ncc(C(C)C)cc1C(F)(F)F.COc1nc(-n2cccn2)c(Cl)cc1C(C)C.COc1nc(-n2nccn2)c(Cl)cc1C(C)C.COc1nc(OC)c(C(C)C)cc1Cl.COc1ncc(C(C)C)cc1C(F)(F)F
InChIInChI=1S/C14H21F3N2O.C14H20F3NO.C12H14ClN3O.C12H12F3N3S.C12H12F3N3.C12H15F3N2O2S.C11H13ClN4O.2C11H11F3N4.C11H13F3N2O.C11H14F3NO.C10H14ClNO2.C10H10F3N5.C10H12F3NO/c1-9(2)11-6-12(14(15,16)17)13(18-7-11)19(4)10(3)8-20-5;1-5-10(4)8-19-13-12(14(15,16)17)6-11(7-18-13)9(2)3;1-8(2)9-7-10(13)11(15-12(9)17-3)16-6-4-5-14-16;1-7(2)8-5-9(12(13,14)15)10(17-6-8)18-11-16-3-4-19-11;1-8(2)9-6-10(12(13,14)15)11(16-7-9)18-5-3-4-17-18;1-8(2)9-6-10(12(13,14)15)11(16-7-9)17-4-3-5-20(17,18)19;1-7(2)8-6-9(12)10(15-11(8)17-3)16-13-4-5-14-16;1-7(2)8-5-9(11(12,13)14)10(15-6-8)18-4-3-16-17-18;1-7(2)8-5-9(11(12,13)14)10(15-6-8)18-16-3-4-17-18;1-6(2)8-4-9(11(12,13)14)10(15-5-8)16-7(3)17;1-7(2)8-4-9(11(12,13)14)10(6-16-3)15-5-8;1-6(2)7-5-8(11)10(14-4)12-9(7)13-3;1-6(2)7-3-8(10(11,12)13)9(14-4-7)18-5-15-16-17-18;1-6(2)7-4-8(10(11,12)13)9(15-3)14-5-7/h6-7,9-10H,8H2,1-5H3;6-7,9-10H,5,8H2,1-4H3;4-8H,1-3H3;3-7H,1-2H3,(H,16,17,18);3-8H,1-2H3;6-8H,3-5H2,1-2H3;4-7H,1-3H3;2*3-7H,1-2H3;4-6H,1-3H3,(H,15,16,17);4-5,7H,6H2,1-3H3;5-6H,1-4H3;3-6H,1-2H3;4-6H,1-3H3
InChIKeyFSIIHSANOPIAMQ-UHFFFAOYSA-N
XLogP44.91
TPSA520.31 Ų
H-Bond Donors2
H-Bond Acceptors46
Rotatable Bonds39
Heavy Atoms246
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003604.97
LogP ≤ 544.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1046

Analyze 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide with MolForge

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Launch Full Analysis

Related Compounds

2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(1,2,4-triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine
CID 158182193
3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;bis(5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine);3-chloro-2-methoxy-5-propan-2-yl-6-(triazol-2-yl)pyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;bis(5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine);5-propan-2-yl-2-(1,2,4-triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide
CID 159440695

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide?
The IUPAC name of 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide (CID 158127227) is 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide.
What is the SMILES notation for 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide?
The canonical SMILES for 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide is CC(=O)Nc1ncc(C(C)C)cc1C(F)(F)F.CC(C)c1cnc(-n2cccn2)c(C(F)(F)F)c1.CC(C)c1cnc(-n2ccnn2)c(C(F)(F)F)c1.CC(C)c1cnc(-n2cnnn2)c(C(F)(F)F)c1.CC(C)c1cnc(-n2nccn2)c(C(F)(F)F)c1.CC(C)c1cnc(N2CCCS2(=O)=O)c(C(F)(F)F)c1.CC(C)c1cnc(Nc2nccs2)c(C(F)(F)F)c1.CCC(C)COc1ncc(C(C)C)cc1C(F)(F)F.COCC(C)N(C)c1ncc(C(C)C)cc1C(F)(F)F.COCc1ncc(C(C)C)cc1C(F)(F)F.COc1nc(-n2cccn2)c(Cl)cc1C(C)C.COc1nc(-n2nccn2)c(Cl)cc1C(C)C.COc1nc(OC)c(C(C)C)cc1Cl.COc1ncc(C(C)C)cc1C(F)(F)F.
What is the InChIKey of 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide?
The InChIKey is FSIIHSANOPIAMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21F3N2O.C14H20F3NO.C12H14ClN3O.C12H12F3N3S.C12H12F3N3.C12H15F3N2O2S.C11H13ClN4O.2C11H11F3N4.C11H13F3N2O.C11H14F3NO.C10H14ClNO2.C10H10F3N5.C10H12F3NO/c1-9(2)11-6-12(14(15,16)17)13(18-7-11)19(4)10(3)8-20-5;1-5-10(4)8-19-13-12(14(15,16)17)6-11(7-18-13)9(2)3;1-8(2)9-7-10(13)11(15-12(9)17-3)16-6-4-5-14-16;1-7(2)8-5-9(12(13,14)15)10(17-6-8)18-11-16-3-4-19-11;1-8(2)9-6-10(12(13,14)15)11(16-7-9)18-5-3-4-17-18;1-8(2)9-6-10(12(13,14)15)11(16-7-9)17-4-3-5-20(17,18)19;1-7(2)8-6-9(12)10(15-11(8)17-3)16-13-4-5-14-16;1-7(2)8-5-9(11(12,13)14)10(15-6-8)18-4-3-16-17-18;1-7(2)8-5-9(11(12,13)14)10(15-6-8)18-16-3-4-17-18;1-6(2)8-4-9(11(12,13)14)10(15-5-8)16-7(3)17;1-7(2)8-4-9(11(12,13)14)10(6-16-3)15-5-8;1-6(2)7-5-8(11)10(14-4)12-9(7)13-3;1-6(2)7-3-8(10(11,12)13)9(14-4-7)18-5-15-16-17-18;1-6(2)7-4-8(10(11,12)13)9(15-3)14-5-7/h6-7,9-10H,8H2,1-5H3;6-7,9-10H,5,8H2,1-4H3;4-8H,1-3H3;3-7H,1-2H3,(H,16,17,18);3-8H,1-2H3;6-8H,3-5H2,1-2H3;4-7H,1-3H3;2*3-7H,1-2H3;4-6H,1-3H3,(H,15,16,17);4-5,7H,6H2,1-3H3;5-6H,1-4H3;3-6H,1-2H3;4-6H,1-3H3.
What are the key properties of 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide?
3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide has a molecular weight of 3604.97 g/mol, XLogP of 44.91, 39 rotatable bonds, 2 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2,6-dimethoxy-5-propan-2-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-pyrazol-1-ylpyridine;5-chloro-2-methoxy-3-propan-2-yl-6-(triazol-2-yl)pyridine;2-(methoxymethyl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;2-methoxy-5-propan-2-yl-3-(trifluoromethyl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-pyrazol-1-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(tetrazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-1-yl)-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)-3-(trifluoromethyl)pyridine;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]acetamide;N-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine;2-[5-propan-2-yl-3-(trifluoromethyl)-2-pyridinyl]-1,2-thiazolidine 1,1-dioxide is sourced from PubChem (CID 158127227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).