2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine

C167H217F18N29O8S — CID 160998213

IUPAC2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine
SMILESCC(C)c1ccc(N2CCC2)nc1.CC(C)c1ccc(S(C)(=O)=O)cn1.CC(C)c1ccc2nc(N(C)CCO)ncc2c1.CC(C)c1ccc2nc(N3CCOCC3)ncc2c1.CC(C)c1cnc(C(F)(F)F)cc1C(F)(F)F.CC(C)c1cnc(N2CCC2)c(C(F)(F)F)c1.CC(C)c1cnc(N2CCC2)cc1F.CC(C)c1cnc(N2CCOCC2)c(F)c1.CC(C)c1cncc2[nH]ccc12.CC(C)c1cnccc1C#N.CC(C)c1ncc(C(F)(F)F)cc1C(F)(F)F.CC(C)c1ncc(C(N)=O)cc1F.Cc1cc(C(C)C)cnc1N1CCOCC1.Cc1cc(C(N)=O)cnc1C(C)C.Cc1cc(N2CCC2)cnc1C(C)C
InChIInChI=1S/C15H19N3O.C14H19N3O.C13H20N2O.C12H15F3N2.C12H17FN2O.C12H18N2.C11H15FN2.C11H16N2.2C10H9F6N.C10H14N2O.C10H12N2.C9H11FN2O.C9H10N2.C9H13NO2S/c1-11(2)12-3-4-14-13(9-12)10-16-15(17-14)18-5-7-19-8-6-18;1-10(2)11-4-5-13-12(8-11)9-15-14(16-13)17(3)6-7-18;1-10(2)12-8-11(3)13(14-9-12)15-4-6-16-7-5-15;1-8(2)9-6-10(12(13,14)15)11(16-7-9)17-4-3-5-17;1-9(2)10-7-11(13)12(14-8-10)15-3-5-16-6-4-15;1-9(2)12-10(3)7-11(8-13-12)14-5-4-6-14;1-8(2)9-7-13-11(6-10(9)12)14-4-3-5-14;1-9(2)10-4-5-11(12-8-10)13-6-3-7-13;1-5(2)6-4-17-8(10(14,15)16)3-7(6)9(11,12)13;1-5(2)8-7(10(14,15)16)3-6(4-17-8)9(11,12)13;1-6(2)9-7(3)4-8(5-12-9)10(11)13;1-7(2)9-5-11-6-10-8(9)3-4-12-10;1-5(2)8-7(10)3-6(4-12-8)9(11)13;1-7(2)9-6-11-4-3-8(9)5-10;1-7(2)9-5-4-8(6-10-9)13(3,11)12/h3-4,9-11H,5-8H2,1-2H3;4-5,8-10,18H,6-7H2,1-3H3;8-10H,4-7H2,1-3H3;6-8H,3-5H2,1-2H3;7-9H,3-6H2,1-2H3;7-9H,4-6H2,1-3H3;6-8H,3-5H2,1-2H3;4-5,8-9H,3,6-7H2,1-2H3;2*3-5H,1-2H3;4-6H,1-3H3,(H2,11,13);3-7,12H,1-2H3;3-5H,1-2H3,(H2,11,13);3-4,6-7H,1-2H3;4-7H,1-3H3
InChIKeyTVNHGRDOXSKECC-UHFFFAOYSA-N
MW3132.80 g/mol
LogP38.34
Rot. Bonds28

About 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine

2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine (PubChem CID 160998213) has the molecular formula C167H217F18N29O8S and a molecular weight of 3132.80 g/mol. Its IUPAC name is 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine.

Molecular Properties

Compound Name2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine
PubChem CID160998213
Molecular FormulaC167H217F18N29O8S
Molecular Weight3132.80 g/mol
Exact Mass3130.69
IUPAC Name2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine
SMILESCC(C)c1ccc(N2CCC2)nc1.CC(C)c1ccc(S(C)(=O)=O)cn1.CC(C)c1ccc2nc(N(C)CCO)ncc2c1.CC(C)c1ccc2nc(N3CCOCC3)ncc2c1.CC(C)c1cnc(C(F)(F)F)cc1C(F)(F)F.CC(C)c1cnc(N2CCC2)c(C(F)(F)F)c1.CC(C)c1cnc(N2CCC2)cc1F.CC(C)c1cnc(N2CCOCC2)c(F)c1.CC(C)c1cncc2[nH]ccc12.CC(C)c1cnccc1C#N.CC(C)c1ncc(C(F)(F)F)cc1C(F)(F)F.CC(C)c1ncc(C(N)=O)cc1F.Cc1cc(C(C)C)cnc1N1CCOCC1.Cc1cc(C(N)=O)cnc1C(C)C.Cc1cc(N2CCC2)cnc1C(C)C
InChIInChI=1S/C15H19N3O.C14H19N3O.C13H20N2O.C12H15F3N2.C12H17FN2O.C12H18N2.C11H15FN2.C11H16N2.2C10H9F6N.C10H14N2O.C10H12N2.C9H11FN2O.C9H10N2.C9H13NO2S/c1-11(2)12-3-4-14-13(9-12)10-16-15(17-14)18-5-7-19-8-6-18;1-10(2)11-4-5-13-12(8-11)9-15-14(16-13)17(3)6-7-18;1-10(2)12-8-11(3)13(14-9-12)15-4-6-16-7-5-15;1-8(2)9-6-10(12(13,14)15)11(16-7-9)17-4-3-5-17;1-9(2)10-7-11(13)12(14-8-10)15-3-5-16-6-4-15;1-9(2)12-10(3)7-11(8-13-12)14-5-4-6-14;1-8(2)9-7-13-11(6-10(9)12)14-4-3-5-14;1-9(2)10-4-5-11(12-8-10)13-6-3-7-13;1-5(2)6-4-17-8(10(14,15)16)3-7(6)9(11,12)13;1-5(2)8-7(10(14,15)16)3-6(4-17-8)9(11,12)13;1-6(2)9-7(3)4-8(5-12-9)10(11)13;1-7(2)9-5-11-6-10-8(9)3-4-12-10;1-5(2)8-7(10)3-6(4-12-8)9(11)13;1-7(2)9-6-11-4-3-8(9)5-10;1-7(2)9-5-4-8(6-10-9)13(3,11)12/h3-4,9-11H,5-8H2,1-2H3;4-5,8-10,18H,6-7H2,1-3H3;8-10H,4-7H2,1-3H3;6-8H,3-5H2,1-2H3;7-9H,3-6H2,1-2H3;7-9H,4-6H2,1-3H3;6-8H,3-5H2,1-2H3;4-5,8-9H,3,6-7H2,1-2H3;2*3-5H,1-2H3;4-6H,1-3H3,(H2,11,13);3-7,12H,1-2H3;3-5H,1-2H3,(H2,11,13);3-4,6-7H,1-2H3;4-7H,1-3H3
InChIKeyTVNHGRDOXSKECC-UHFFFAOYSA-N
XLogP38.34
TPSA452.87 Ų
H-Bond Donors4
H-Bond Acceptors34
Rotatable Bonds28
Heavy Atoms223
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003132.80
LogP ≤ 538.34
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1034

Analyze 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine with MolForge

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Launch Full Analysis

Related Compounds

2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;2-[methyl-(6-propan-2-yl-3H-indol-2-yl)amino]ethanol;5-methyl-6-propan-2-ylpyridine-3-carboxamide;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;4-(6-propan-2-yl-3H-indol-2-yl)morpholine;3-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylquinazoline;4-(6-propan-2-ylquinazolin-2-yl)morpholine
CID 157405373
2-(Azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;5-methyl-6-propan-2-ylpyridine-3-carboxamide;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-(6-propan-2-ylquinazolin-2-yl)morpholine
CID 157524189
2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;2-[methyl-(6-propan-2-yl-3H-indol-2-yl)amino]ethanol;5-methyl-6-propan-2-ylpyridine-3-carboxamide;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;1-methylsulfonyl-4-propan-2-ylbenzene;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;4-(6-propan-2-yl-3H-indol-2-yl)morpholine;3-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylquinazoline;4-(6-propan-2-ylquinazolin-2-yl)morpholine
CID 159395777
5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;2-[methyl-(6-propan-2-yl-3H-indol-2-yl)amino]ethanol;5-methyl-6-propan-2-ylpyridine-3-carboxamide;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;4-(6-propan-2-yl-3H-indol-2-yl)morpholine;6-propan-2-ylquinazoline;4-(6-propan-2-ylquinazolin-2-yl)morpholine
CID 160145957
2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;3-fluoro-5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;1-methyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine
CID 160619434
2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;4-(6-propan-2-yl-3H-indol-2-yl)morpholine;3-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylquinazoline;4-(6-propan-2-ylquinazolin-2-yl)morpholine
CID 161989182
N,N-dimethyl-5-(5-propan-2-yl-3-pyridinyl)pyrimidin-2-amine;3-(4-fluorophenyl)-5-propan-2-ylpyridine;4-[3-fluoro-4-(5-propan-2-yl-3-pyridinyl)-2-pyridinyl]morpholine;1-methyl-4-[5-(5-propan-2-yl-3-pyridinyl)-2-pyridinyl]piperazine;morpholin-4-yl-[5-(5-propan-2-yl-3-pyridinyl)-3-pyridinyl]methanone;5-(5-propan-2-yl-3-pyridinyl)-1H-indole;2-(5-propan-2-yl-3-pyridinyl)pyrazine;5-(5-propan-2-yl-3-pyridinyl)pyridine-2-carbonitrile;3-propan-2-yl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine
CID 160472112

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine?
The IUPAC name of 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine (CID 160998213) is 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine.
What is the SMILES notation for 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine?
The canonical SMILES for 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine is CC(C)c1ccc(N2CCC2)nc1.CC(C)c1ccc(S(C)(=O)=O)cn1.CC(C)c1ccc2nc(N(C)CCO)ncc2c1.CC(C)c1ccc2nc(N3CCOCC3)ncc2c1.CC(C)c1cnc(C(F)(F)F)cc1C(F)(F)F.CC(C)c1cnc(N2CCC2)c(C(F)(F)F)c1.CC(C)c1cnc(N2CCC2)cc1F.CC(C)c1cnc(N2CCOCC2)c(F)c1.CC(C)c1cncc2[nH]ccc12.CC(C)c1cnccc1C#N.CC(C)c1ncc(C(F)(F)F)cc1C(F)(F)F.CC(C)c1ncc(C(N)=O)cc1F.Cc1cc(C(C)C)cnc1N1CCOCC1.Cc1cc(C(N)=O)cnc1C(C)C.Cc1cc(N2CCC2)cnc1C(C)C.
What is the InChIKey of 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine?
The InChIKey is TVNHGRDOXSKECC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O.C14H19N3O.C13H20N2O.C12H15F3N2.C12H17FN2O.C12H18N2.C11H15FN2.C11H16N2.2C10H9F6N.C10H14N2O.C10H12N2.C9H11FN2O.C9H10N2.C9H13NO2S/c1-11(2)12-3-4-14-13(9-12)10-16-15(17-14)18-5-7-19-8-6-18;1-10(2)11-4-5-13-12(8-11)9-15-14(16-13)17(3)6-7-18;1-10(2)12-8-11(3)13(14-9-12)15-4-6-16-7-5-15;1-8(2)9-6-10(12(13,14)15)11(16-7-9)17-4-3-5-17;1-9(2)10-7-11(13)12(14-8-10)15-3-5-16-6-4-15;1-9(2)12-10(3)7-11(8-13-12)14-5-4-6-14;1-8(2)9-7-13-11(6-10(9)12)14-4-3-5-14;1-9(2)10-4-5-11(12-8-10)13-6-3-7-13;1-5(2)6-4-17-8(10(14,15)16)3-7(6)9(11,12)13;1-5(2)8-7(10(14,15)16)3-6(4-17-8)9(11,12)13;1-6(2)9-7(3)4-8(5-12-9)10(11)13;1-7(2)9-5-11-6-10-8(9)3-4-12-10;1-5(2)8-7(10)3-6(4-12-8)9(11)13;1-7(2)9-6-11-4-3-8(9)5-10;1-7(2)9-5-4-8(6-10-9)13(3,11)12/h3-4,9-11H,5-8H2,1-2H3;4-5,8-10,18H,6-7H2,1-3H3;8-10H,4-7H2,1-3H3;6-8H,3-5H2,1-2H3;7-9H,3-6H2,1-2H3;7-9H,4-6H2,1-3H3;6-8H,3-5H2,1-2H3;4-5,8-9H,3,6-7H2,1-2H3;2*3-5H,1-2H3;4-6H,1-3H3,(H2,11,13);3-7,12H,1-2H3;3-5H,1-2H3,(H2,11,13);3-4,6-7H,1-2H3;4-7H,1-3H3.
What are the key properties of 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine?
2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine has a molecular weight of 3132.80 g/mol, XLogP of 38.34, 28 rotatable bonds, 4 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-yl)-4-fluoro-5-propan-2-ylpyridine;5-(azetidin-1-yl)-3-methyl-2-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-ylpyridine;2-(azetidin-1-yl)-5-propan-2-yl-3-(trifluoromethyl)pyridine;5-fluoro-6-propan-2-ylpyridine-3-carboxamide;4-(3-fluoro-5-propan-2-yl-2-pyridinyl)morpholine;5-methyl-6-propan-2-ylpyridine-3-carboxamide;4-(3-methyl-5-propan-2-yl-2-pyridinyl)morpholine;2-[methyl-(6-propan-2-ylquinazolin-2-yl)amino]ethanol;5-methylsulfonyl-2-propan-2-ylpyridine;2-propan-2-yl-3,5-bis(trifluoromethyl)pyridine;5-propan-2-yl-2,4-bis(trifluoromethyl)pyridine;3-propan-2-ylpyridine-4-carbonitrile;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-(6-propan-2-ylquinazolin-2-yl)morpholine is sourced from PubChem (CID 160998213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).