5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol

C184H266ClFN38O10S2 — CID 158733870

IUPAC5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol
SMILESCC(C)c1cc(C#N)ccn1.CC(C)c1cc(C(N)=O)ccn1.CC(C)c1cc(CO)ccn1.CC(C)c1cc(N)c(N)cn1.CC(C)c1cc(N2CCN(CCO)CC2)ncn1.CC(C)c1cc(N2CCOCC2)ncn1.CC(C)c1ccc(C#N)cn1.CC(C)c1ccc(C2CNC2)cn1.CC(C)c1ccc(CO)cn1.CC(C)c1ccc(Cl)cn1.CC(C)c1ccc(F)cn1.CC(C)c1ccc(S(=O)(=O)N(C)C)cn1.CC(C)c1ccc(S(=O)(=O)N2CCCCC2)cn1.CC(C)c1ccccn1.CC(C)c1ccncn1.Cc1cc(C(C)C)nc(C)n1.Cc1cc(C(C)C)ncc1C#N.Cc1ccnc(C(C)C)c1.Cc1nc(C(C)C)cc(N2CCN(CCO)CC2)n1
InChIInChI=1S/C14H24N4O.C13H22N4O.C13H20N2O2S.C11H17N3O.C11H16N2.C10H16N2O2S.C10H12N2.C9H12N2O.C9H14N2.2C9H10N2.2C9H13NO.C9H13N.C8H10ClN.C8H10FN.C8H13N3.C8H11N.C7H10N2/c1-11(2)13-10-14(16-12(3)15-13)18-6-4-17(5-7-18)8-9-19;1-11(2)12-9-13(15-10-14-12)17-5-3-16(4-6-17)7-8-18;1-11(2)13-7-6-12(10-14-13)18(16,17)15-8-4-3-5-9-15;1-9(2)10-7-11(13-8-12-10)14-3-5-15-6-4-14;1-8(2)11-4-3-9(7-13-11)10-5-12-6-10;1-8(2)10-6-5-9(7-11-10)15(13,14)12(3)4;1-7(2)10-4-8(3)9(5-11)6-12-10;1-6(2)8-5-7(9(10)12)3-4-11-8;1-6(2)9-5-7(3)10-8(4)11-9;1-7(2)9-5-8(6-10)3-4-11-9;1-7(2)9-4-3-8(5-10)6-11-9;1-7(2)9-5-8(6-11)3-4-10-9;1-7(2)9-4-3-8(6-11)5-10-9;1-7(2)9-6-8(3)4-5-10-9;2*1-6(2)8-4-3-7(9)5-10-8;1-5(2)8-3-6(9)7(10)4-11-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-4-8-5-9-7/h10-11,19H,4-9H2,1-3H3;9-11,18H,3-8H2,1-2H3;6-7,10-11H,3-5,8-9H2,1-2H3;7-9H,3-6H2,1-2H3;3-4,7-8,10,12H,5-6H2,1-2H3;5-8H,1-4H3;4,6-7H,1-3H3;3-6H,1-2H3,(H2,10,12);5-6H,1-4H3;3-5,7H,1-2H3;3-4,6-7H,1-2H3;2*3-5,7,11H,6H2,1-2H3;4-7H,1-3H3;2*3-6H,1-2H3;3-5H,10H2,1-2H3,(H2,9,11);3-7H,1-2H3;3-6H,1-2H3
InChIKeyILKUZMMZUZZQBS-UHFFFAOYSA-N
MW3288.99 g/mol
LogP35.24
Rot. Bonds34

About 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol

5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol (PubChem CID 158733870) has the molecular formula C184H266ClFN38O10S2 and a molecular weight of 3288.99 g/mol. Its IUPAC name is 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol
PubChem CID158733870
Molecular FormulaC184H266ClFN38O10S2
Molecular Weight3288.99 g/mol
Exact Mass3286.06
IUPAC Name5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol
SMILESCC(C)c1cc(C#N)ccn1.CC(C)c1cc(C(N)=O)ccn1.CC(C)c1cc(CO)ccn1.CC(C)c1cc(N)c(N)cn1.CC(C)c1cc(N2CCN(CCO)CC2)ncn1.CC(C)c1cc(N2CCOCC2)ncn1.CC(C)c1ccc(C#N)cn1.CC(C)c1ccc(C2CNC2)cn1.CC(C)c1ccc(CO)cn1.CC(C)c1ccc(Cl)cn1.CC(C)c1ccc(F)cn1.CC(C)c1ccc(S(=O)(=O)N(C)C)cn1.CC(C)c1ccc(S(=O)(=O)N2CCCCC2)cn1.CC(C)c1ccccn1.CC(C)c1ccncn1.Cc1cc(C(C)C)nc(C)n1.Cc1cc(C(C)C)ncc1C#N.Cc1ccnc(C(C)C)c1.Cc1nc(C(C)C)cc(N2CCN(CCO)CC2)n1
InChIInChI=1S/C14H24N4O.C13H22N4O.C13H20N2O2S.C11H17N3O.C11H16N2.C10H16N2O2S.C10H12N2.C9H12N2O.C9H14N2.2C9H10N2.2C9H13NO.C9H13N.C8H10ClN.C8H10FN.C8H13N3.C8H11N.C7H10N2/c1-11(2)13-10-14(16-12(3)15-13)18-6-4-17(5-7-18)8-9-19;1-11(2)12-9-13(15-10-14-12)17-5-3-16(4-6-17)7-8-18;1-11(2)13-7-6-12(10-14-13)18(16,17)15-8-4-3-5-9-15;1-9(2)10-7-11(13-8-12-10)14-3-5-15-6-4-14;1-8(2)11-4-3-9(7-13-11)10-5-12-6-10;1-8(2)10-6-5-9(7-11-10)15(13,14)12(3)4;1-7(2)10-4-8(3)9(5-11)6-12-10;1-6(2)8-5-7(9(10)12)3-4-11-8;1-6(2)9-5-7(3)10-8(4)11-9;1-7(2)9-5-8(6-10)3-4-11-9;1-7(2)9-4-3-8(5-10)6-11-9;1-7(2)9-5-8(6-11)3-4-10-9;1-7(2)9-4-3-8(6-11)5-10-9;1-7(2)9-6-8(3)4-5-10-9;2*1-6(2)8-4-3-7(9)5-10-8;1-5(2)8-3-6(9)7(10)4-11-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-4-8-5-9-7/h10-11,19H,4-9H2,1-3H3;9-11,18H,3-8H2,1-2H3;6-7,10-11H,3-5,8-9H2,1-2H3;7-9H,3-6H2,1-2H3;3-4,7-8,10,12H,5-6H2,1-2H3;5-8H,1-4H3;4,6-7H,1-3H3;3-6H,1-2H3,(H2,10,12);5-6H,1-4H3;3-5,7H,1-2H3;3-4,6-7H,1-2H3;2*3-5,7,11H,6H2,1-2H3;4-7H,1-3H3;2*3-6H,1-2H3;3-5H,10H2,1-2H3,(H2,9,11);3-7H,1-2H3;3-6H,1-2H3
InChIKeyILKUZMMZUZZQBS-UHFFFAOYSA-N
XLogP35.24
TPSA669.00 Ų
H-Bond Donors8
H-Bond Acceptors45
Rotatable Bonds34
Heavy Atoms236
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003288.99
LogP ≤ 535.24
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1045

Analyze 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol with MolForge

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Launch Full Analysis

Related Compounds

4-(5-Chloro-2-propan-2-yl-3-pyridinyl)morpholine;4-(5-fluoro-6-propan-2-yl-3-pyridinyl)morpholine;1-(5-fluoro-6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-methyl-4-methylsulfonyl-5-propan-2-ylpyrimidine;2-methyl-5-propan-2-ylpyridine-4-carboxamide;4-methyl-5-propan-2-yl-2-pyridin-2-ylpyrimidine;4-methyl-5-propan-2-yl-2-pyridin-4-ylpyrimidine;3-propan-2-ylpyridine-4-carboxamide;4-(6-propan-2-yl-3-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol;5-propan-2-yl-2-pyridin-2-yl-4-(trifluoromethyl)pyrimidine;5-propan-2-yl-2-pyridin-4-yl-4-(trifluoromethyl)pyrimidine
CID 157153250
5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol
CID 162164696

Frequently Asked Questions

What is the IUPAC name of 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol?
The IUPAC name of 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol (CID 158733870) is 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol.
What is the SMILES notation for 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol?
The canonical SMILES for 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol is CC(C)c1cc(C#N)ccn1.CC(C)c1cc(C(N)=O)ccn1.CC(C)c1cc(CO)ccn1.CC(C)c1cc(N)c(N)cn1.CC(C)c1cc(N2CCN(CCO)CC2)ncn1.CC(C)c1cc(N2CCOCC2)ncn1.CC(C)c1ccc(C#N)cn1.CC(C)c1ccc(C2CNC2)cn1.CC(C)c1ccc(CO)cn1.CC(C)c1ccc(Cl)cn1.CC(C)c1ccc(F)cn1.CC(C)c1ccc(S(=O)(=O)N(C)C)cn1.CC(C)c1ccc(S(=O)(=O)N2CCCCC2)cn1.CC(C)c1ccccn1.CC(C)c1ccncn1.Cc1cc(C(C)C)nc(C)n1.Cc1cc(C(C)C)ncc1C#N.Cc1ccnc(C(C)C)c1.Cc1nc(C(C)C)cc(N2CCN(CCO)CC2)n1.
What is the InChIKey of 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol?
The InChIKey is ILKUZMMZUZZQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O.C13H22N4O.C13H20N2O2S.C11H17N3O.C11H16N2.C10H16N2O2S.C10H12N2.C9H12N2O.C9H14N2.2C9H10N2.2C9H13NO.C9H13N.C8H10ClN.C8H10FN.C8H13N3.C8H11N.C7H10N2/c1-11(2)13-10-14(16-12(3)15-13)18-6-4-17(5-7-18)8-9-19;1-11(2)12-9-13(15-10-14-12)17-5-3-16(4-6-17)7-8-18;1-11(2)13-7-6-12(10-14-13)18(16,17)15-8-4-3-5-9-15;1-9(2)10-7-11(13-8-12-10)14-3-5-15-6-4-14;1-8(2)11-4-3-9(7-13-11)10-5-12-6-10;1-8(2)10-6-5-9(7-11-10)15(13,14)12(3)4;1-7(2)10-4-8(3)9(5-11)6-12-10;1-6(2)8-5-7(9(10)12)3-4-11-8;1-6(2)9-5-7(3)10-8(4)11-9;1-7(2)9-5-8(6-10)3-4-11-9;1-7(2)9-4-3-8(5-10)6-11-9;1-7(2)9-5-8(6-11)3-4-10-9;1-7(2)9-4-3-8(6-11)5-10-9;1-7(2)9-6-8(3)4-5-10-9;2*1-6(2)8-4-3-7(9)5-10-8;1-5(2)8-3-6(9)7(10)4-11-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-4-8-5-9-7/h10-11,19H,4-9H2,1-3H3;9-11,18H,3-8H2,1-2H3;6-7,10-11H,3-5,8-9H2,1-2H3;7-9H,3-6H2,1-2H3;3-4,7-8,10,12H,5-6H2,1-2H3;5-8H,1-4H3;4,6-7H,1-3H3;3-6H,1-2H3,(H2,10,12);5-6H,1-4H3;3-5,7H,1-2H3;3-4,6-7H,1-2H3;2*3-5,7,11H,6H2,1-2H3;4-7H,1-3H3;2*3-6H,1-2H3;3-5H,10H2,1-2H3,(H2,9,11);3-7H,1-2H3;3-6H,1-2H3.
What are the key properties of 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol?
5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol has a molecular weight of 3288.99 g/mol, XLogP of 35.24, 34 rotatable bonds, 8 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(azetidin-3-yl)-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-6-propan-2-ylpyridine-3-sulfonamide;2,4-dimethyl-6-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-3-carbonitrile;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;5-piperidin-1-ylsulfonyl-2-propan-2-ylpyridine;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-ylpyridine-4-carboxamide;6-propan-2-ylpyridine-3,4-diamine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol is sourced from PubChem (CID 158733870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).