3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile

C159H190BrCl7F4N42O7 — CID 160621240

IUPAC3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile
SMILESC.CC(C)c1cnc(-c2ccnn2C)c(Cl)c1.CC(C)c1cnc(-c2cnoc2)c(Cl)c1.CC(C)c1cnc(-n2cccn2)c(C(F)F)c1.CC(C)c1cnc(-n2cccn2)c(Cl)c1.CC(C)c1cnc(-n2ccnn2)c(Cl)c1.CC(C)c1cnc(-n2nccn2)c(C#N)c1.CC(C)c1cnc(-n2nccn2)c(C(F)F)c1.CC(C)c1cnc(-n2nccn2)c(Cl)c1.CC(C)c1cnc(OCCC2CCN(C)CC2)c(Cl)c1.COc1cc(C(C)C)cnc1-n1cccn1.COc1cc(C(C)C)cnc1-n1nccn1.COc1ncc(C(C)C)cc1Br.COc1ncc(C(C)C)cc1C#N.Cc1cnc(-c2ncc(C(C)C)cc2Cl)o1
InChIInChI=1S/C16H25ClN2O.C12H14ClN3.C12H13ClN2O.C12H13F2N3.C12H15N3O.C11H12ClN3.C11H11ClN2O.C11H12F2N4.C11H11N5.C11H14N4O.2C10H11ClN4.C10H12N2O.C9H12BrNO.CH4/c1-12(2)14-10-15(17)16(18-11-14)20-9-6-13-4-7-19(3)8-5-13;1-8(2)9-6-10(13)12(14-7-9)11-4-5-15-16(11)3;1-7(2)9-4-10(13)11(14-6-9)12-15-5-8(3)16-12;1-8(2)9-6-10(11(13)14)12(15-7-9)17-5-3-4-16-17;1-9(2)10-7-11(16-3)12(13-8-10)15-6-4-5-14-15;1-8(2)9-6-10(12)11(13-7-9)15-5-3-4-14-15;1-7(2)8-3-10(12)11(13-4-8)9-5-14-15-6-9;1-7(2)8-5-9(10(12)13)11(14-6-8)17-15-3-4-16-17;1-8(2)10-5-9(6-12)11(13-7-10)16-14-3-4-15-16;1-8(2)9-6-10(16-3)11(12-7-9)15-13-4-5-14-15;1-7(2)8-5-9(11)10(12-6-8)15-4-3-13-14-15;1-7(2)8-5-9(11)10(12-6-8)15-13-3-4-14-15;1-7(2)9-4-8(5-11)10(13-3)12-6-9;1-6(2)7-4-8(10)9(12-3)11-5-7;/h10-13H,4-9H2,1-3H3;4-8H,1-3H3;4-7H,1-3H3;3-8,11H,1-2H3;4-9H,1-3H3;3-8H,1-2H3;3-7H,1-2H3;3-7,10H,1-2H3;3-5,7-8H,1-2H3;4-8H,1-3H3;2*3-7H,1-2H3;4,6-7H,1-3H3;4-6H,1-3H3;1H4
InChIKeyRGSOKNTVEWOGPG-UHFFFAOYSA-N
MW3205.62 g/mol
LogP40.09
Rot. Bonds35

About 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile

3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile (PubChem CID 160621240) has the molecular formula C159H190BrCl7F4N42O7 and a molecular weight of 3205.62 g/mol. Its IUPAC name is 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile
PubChem CID160621240
Molecular FormulaC159H190BrCl7F4N42O7
Molecular Weight3205.62 g/mol
Exact Mass3199.27
IUPAC Name3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile
SMILESC.CC(C)c1cnc(-c2ccnn2C)c(Cl)c1.CC(C)c1cnc(-c2cnoc2)c(Cl)c1.CC(C)c1cnc(-n2cccn2)c(C(F)F)c1.CC(C)c1cnc(-n2cccn2)c(Cl)c1.CC(C)c1cnc(-n2ccnn2)c(Cl)c1.CC(C)c1cnc(-n2nccn2)c(C#N)c1.CC(C)c1cnc(-n2nccn2)c(C(F)F)c1.CC(C)c1cnc(-n2nccn2)c(Cl)c1.CC(C)c1cnc(OCCC2CCN(C)CC2)c(Cl)c1.COc1cc(C(C)C)cnc1-n1cccn1.COc1cc(C(C)C)cnc1-n1nccn1.COc1ncc(C(C)C)cc1Br.COc1ncc(C(C)C)cc1C#N.Cc1cnc(-c2ncc(C(C)C)cc2Cl)o1
InChIInChI=1S/C16H25ClN2O.C12H14ClN3.C12H13ClN2O.C12H13F2N3.C12H15N3O.C11H12ClN3.C11H11ClN2O.C11H12F2N4.C11H11N5.C11H14N4O.2C10H11ClN4.C10H12N2O.C9H12BrNO.CH4/c1-12(2)14-10-15(17)16(18-11-14)20-9-6-13-4-7-19(3)8-5-13;1-8(2)9-6-10(13)12(14-7-9)11-4-5-15-16(11)3;1-7(2)9-4-10(13)11(14-6-9)12-15-5-8(3)16-12;1-8(2)9-6-10(11(13)14)12(15-7-9)17-5-3-4-16-17;1-9(2)10-7-11(16-3)12(13-8-10)15-6-4-5-14-15;1-8(2)9-6-10(12)11(13-7-9)15-5-3-4-14-15;1-7(2)8-3-10(12)11(13-4-8)9-5-14-15-6-9;1-7(2)8-5-9(10(12)13)11(14-6-8)17-15-3-4-16-17;1-8(2)10-5-9(6-12)11(13-7-10)16-14-3-4-15-16;1-8(2)9-6-10(16-3)11(12-7-9)15-13-4-5-14-15;1-7(2)8-5-9(11)10(12-6-8)15-4-3-13-14-15;1-7(2)8-5-9(11)10(12-6-8)15-13-3-4-14-15;1-7(2)9-4-8(5-11)10(13-3)12-6-9;1-6(2)7-4-8(10)9(12-3)11-5-7;/h10-13H,4-9H2,1-3H3;4-8H,1-3H3;4-7H,1-3H3;3-8,11H,1-2H3;4-9H,1-3H3;3-8H,1-2H3;3-7H,1-2H3;3-7,10H,1-2H3;3-5,7-8H,1-2H3;4-8H,1-3H3;2*3-7H,1-2H3;4,6-7H,1-3H3;4-6H,1-3H3;1H4
InChIKeyRGSOKNTVEWOGPG-UHFFFAOYSA-N
XLogP40.09
TPSA554.32 Ų
H-Bond Donors
H-Bond Acceptors49
Rotatable Bonds35
Heavy Atoms220
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003205.62
LogP ≤ 540.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1049

Analyze 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile with MolForge

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Launch Full Analysis

Related Compounds

5-Bromo-2-chloro-4-propan-2-ylpyridine;2-tert-butyl-1-methylimidazole;2-tert-butylpyridine;3-tert-butylpyridine;2-chloro-4-propan-2-ylpyridine;methane;2-methyl-3-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;2-methyl-3-propan-2-ylpyridine;2-nitro-3-propan-2-ylpyridine;4-propan-2-ylpyridine;4-propan-2-ylpyridine-3-carbonitrile;4-propan-2-yl-3-(trifluoromethyl)pyridine
CID 158437216
3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;bis(3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine);2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;3-chloro-5-propan-2-yl-2-(2H-pyrrol-4-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;N-(1-methoxypropan-2-yl)-N-methyl-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-amine;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;2-(2-methylbutoxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile
CID 159209938
3-Bromo-2-methoxy-5-propan-2-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile
CID 158150837

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile?
The IUPAC name of 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile (CID 160621240) is 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile?
The canonical SMILES for 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile is C.CC(C)c1cnc(-c2ccnn2C)c(Cl)c1.CC(C)c1cnc(-c2cnoc2)c(Cl)c1.CC(C)c1cnc(-n2cccn2)c(C(F)F)c1.CC(C)c1cnc(-n2cccn2)c(Cl)c1.CC(C)c1cnc(-n2ccnn2)c(Cl)c1.CC(C)c1cnc(-n2nccn2)c(C#N)c1.CC(C)c1cnc(-n2nccn2)c(C(F)F)c1.CC(C)c1cnc(-n2nccn2)c(Cl)c1.CC(C)c1cnc(OCCC2CCN(C)CC2)c(Cl)c1.COc1cc(C(C)C)cnc1-n1cccn1.COc1cc(C(C)C)cnc1-n1nccn1.COc1ncc(C(C)C)cc1Br.COc1ncc(C(C)C)cc1C#N.Cc1cnc(-c2ncc(C(C)C)cc2Cl)o1.
What is the InChIKey of 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile?
The InChIKey is RGSOKNTVEWOGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25ClN2O.C12H14ClN3.C12H13ClN2O.C12H13F2N3.C12H15N3O.C11H12ClN3.C11H11ClN2O.C11H12F2N4.C11H11N5.C11H14N4O.2C10H11ClN4.C10H12N2O.C9H12BrNO.CH4/c1-12(2)14-10-15(17)16(18-11-14)20-9-6-13-4-7-19(3)8-5-13;1-8(2)9-6-10(13)12(14-7-9)11-4-5-15-16(11)3;1-7(2)9-4-10(13)11(14-6-9)12-15-5-8(3)16-12;1-8(2)9-6-10(11(13)14)12(15-7-9)17-5-3-4-16-17;1-9(2)10-7-11(16-3)12(13-8-10)15-6-4-5-14-15;1-8(2)9-6-10(12)11(13-7-9)15-5-3-4-14-15;1-7(2)8-3-10(12)11(13-4-8)9-5-14-15-6-9;1-7(2)8-5-9(10(12)13)11(14-6-8)17-15-3-4-16-17;1-8(2)10-5-9(6-12)11(13-7-10)16-14-3-4-15-16;1-8(2)9-6-10(16-3)11(12-7-9)15-13-4-5-14-15;1-7(2)8-5-9(11)10(12-6-8)15-4-3-13-14-15;1-7(2)8-5-9(11)10(12-6-8)15-13-3-4-14-15;1-7(2)9-4-8(5-11)10(13-3)12-6-9;1-6(2)7-4-8(10)9(12-3)11-5-7;/h10-13H,4-9H2,1-3H3;4-8H,1-3H3;4-7H,1-3H3;3-8,11H,1-2H3;4-9H,1-3H3;3-8H,1-2H3;3-7H,1-2H3;3-7,10H,1-2H3;3-5,7-8H,1-2H3;4-8H,1-3H3;2*3-7H,1-2H3;4,6-7H,1-3H3;4-6H,1-3H3;1H4.
What are the key properties of 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile?
3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile has a molecular weight of 3205.62 g/mol, XLogP of 40.09, 35 rotatable bonds, 0 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-methoxy-5-propan-2-ylpyridine;3-chloro-2-[2-(1-methylpiperidin-4-yl)ethoxy]-5-propan-2-ylpyridine;3-chloro-2-(2-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-chloro-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-(3-chloro-5-propan-2-yl-2-pyridinyl)-5-methyl-1,3-oxazole;4-(3-chloro-5-propan-2-yl-2-pyridinyl)-1,2-oxazole;3-chloro-5-propan-2-yl-2-(triazol-1-yl)pyridine;3-chloro-5-propan-2-yl-2-(triazol-2-yl)pyridine;3-(difluoromethyl)-5-propan-2-yl-2-pyrazol-1-ylpyridine;3-(difluoromethyl)-5-propan-2-yl-2-(triazol-2-yl)pyridine;methane;3-methoxy-5-propan-2-yl-2-pyrazol-1-ylpyridine;2-methoxy-5-propan-2-ylpyridine-3-carbonitrile;3-methoxy-5-propan-2-yl-2-(triazol-2-yl)pyridine;5-propan-2-yl-2-(triazol-2-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 160621240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).