bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline

C182H258F19N35O15 — CID 167591899

IUPACbis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline
SMILESCC(C)Cc1cccn([C@@H]2CCCN(CCC#N)C2)c1=O.CC(C)Cc1cccn([C@H]2CCCN(CCC#N)C2)c1=O.CC(C)Nc1cc(F)cc(F)c1F.CC(C)Nc1cc(F)ccc1F.CC(C)Nc1cc(F)cnc1OC1CC1.CC(C)Nc1cc(F)cnc1OC1CC1.CC(C)Nc1cc(N2CCCC2)nc(C(F)(F)F)c1.CC(C)Nc1cccn([C@@H]2CCN(CCC#N)C2)c1=O.CC(C)Nc1cccn([C@H]2CCN(CCC#N)C2)c1=O.CC(C)Nc1cccnc1OC(F)(F)F.CC(C)Nc1cccnc1OC(F)F.CC(C)Nc1cccnc1OC1CN(CC(F)(F)F)C1.COCCOc1ncc(F)cc1NC(C)C.COCCOc1ncccc1NC(C)C.COCCn1cccc(CC(C)C)c1=O
InChIInChI=1S/2C17H25N3O.2C15H22N4O.C13H18F3N3O.C13H18F3N3.C12H19NO2.C11H17FN2O2.2C11H15FN2O.C11H18N2O2.C9H11F3N2O.C9H10F3N.C9H12F2N2O.C9H11F2N/c2*1-14(2)12-15-6-3-11-20(17(15)21)16-7-4-9-19(13-16)10-5-8-18;2*1-12(2)17-14-5-3-9-19(15(14)20)13-6-10-18(11-13)8-4-7-16;1-9(2)18-11-4-3-5-17-12(11)20-10-6-19(7-10)8-13(14,15)16;1-9(2)17-10-7-11(13(14,15)16)18-12(8-10)19-5-3-4-6-19;1-10(2)9-11-5-4-6-13(12(11)14)7-8-15-3;1-8(2)14-10-6-9(12)7-13-11(10)16-5-4-15-3;2*1-7(2)14-10-5-8(12)6-13-11(10)15-9-3-4-9;1-9(2)13-10-5-4-6-12-11(10)15-8-7-14-3;1-6(2)14-7-4-3-5-13-8(7)15-9(10,11)12;1-5(2)13-8-4-6(10)3-7(11)9(8)12;1-6(2)13-7-4-3-5-12-8(7)14-9(10)11;1-6(2)12-9-5-7(10)3-4-8(9)11/h2*3,6,11,14,16H,4-5,7,9-10,12-13H2,1-2H3;2*3,5,9,12-13,17H,4,6,8,10-11H2,1-2H3;3-5,9-10,18H,6-8H2,1-2H3;7-9H,3-6H2,1-2H3,(H,17,18);4-6,10H,7-9H2,1-3H3;6-8,14H,4-5H2,1-3H3;2*5-7,9,14H,3-4H2,1-2H3;4-6,9,13H,7-8H2,1-3H3;3-6,14H,1-2H3;3-5,13H,1-2H3;3-6,9,13H,1-2H3;3-6,12H,1-2H3/t2*16-;2*13-;;;;;;;;;;;/m1010.........../s1
InChIKeyINTBBYPPVQFBMT-GJJFRISPSA-N
MW3537.26 g/mol
LogP36.77
Rot. Bonds64

About bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline

bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline (PubChem CID 167591899) has the molecular formula C182H258F19N35O15 and a molecular weight of 3537.26 g/mol. Its IUPAC name is bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline.

Molecular Properties

Compound Namebis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline
PubChem CID167591899
Molecular FormulaC182H258F19N35O15
Molecular Weight3537.26 g/mol
Exact Mass3535.02
IUPAC Namebis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline
SMILESCC(C)Cc1cccn([C@@H]2CCCN(CCC#N)C2)c1=O.CC(C)Cc1cccn([C@H]2CCCN(CCC#N)C2)c1=O.CC(C)Nc1cc(F)cc(F)c1F.CC(C)Nc1cc(F)ccc1F.CC(C)Nc1cc(F)cnc1OC1CC1.CC(C)Nc1cc(F)cnc1OC1CC1.CC(C)Nc1cc(N2CCCC2)nc(C(F)(F)F)c1.CC(C)Nc1cccn([C@@H]2CCN(CCC#N)C2)c1=O.CC(C)Nc1cccn([C@H]2CCN(CCC#N)C2)c1=O.CC(C)Nc1cccnc1OC(F)(F)F.CC(C)Nc1cccnc1OC(F)F.CC(C)Nc1cccnc1OC1CN(CC(F)(F)F)C1.COCCOc1ncc(F)cc1NC(C)C.COCCOc1ncccc1NC(C)C.COCCn1cccc(CC(C)C)c1=O
InChIInChI=1S/2C17H25N3O.2C15H22N4O.C13H18F3N3O.C13H18F3N3.C12H19NO2.C11H17FN2O2.2C11H15FN2O.C11H18N2O2.C9H11F3N2O.C9H10F3N.C9H12F2N2O.C9H11F2N/c2*1-14(2)12-15-6-3-11-20(17(15)21)16-7-4-9-19(13-16)10-5-8-18;2*1-12(2)17-14-5-3-9-19(15(14)20)13-6-10-18(11-13)8-4-7-16;1-9(2)18-11-4-3-5-17-12(11)20-10-6-19(7-10)8-13(14,15)16;1-9(2)17-10-7-11(13(14,15)16)18-12(8-10)19-5-3-4-6-19;1-10(2)9-11-5-4-6-13(12(11)14)7-8-15-3;1-8(2)14-10-6-9(12)7-13-11(10)16-5-4-15-3;2*1-7(2)14-10-5-8(12)6-13-11(10)15-9-3-4-9;1-9(2)13-10-5-4-6-12-11(10)15-8-7-14-3;1-6(2)14-7-4-3-5-13-8(7)15-9(10,11)12;1-5(2)13-8-4-6(10)3-7(11)9(8)12;1-6(2)13-7-4-3-5-12-8(7)14-9(10)11;1-6(2)12-9-5-7(10)3-4-8(9)11/h2*3,6,11,14,16H,4-5,7,9-10,12-13H2,1-2H3;2*3,5,9,12-13,17H,4,6,8,10-11H2,1-2H3;3-5,9-10,18H,6-8H2,1-2H3;7-9H,3-6H2,1-2H3,(H,17,18);4-6,10H,7-9H2,1-3H3;6-8,14H,4-5H2,1-3H3;2*5-7,9,14H,3-4H2,1-2H3;4-6,9,13H,7-8H2,1-3H3;3-6,14H,1-2H3;3-5,13H,1-2H3;3-6,9,13H,1-2H3;3-6,12H,1-2H3/t2*16-;2*13-;;;;;;;;;;;/m1010.........../s1
InChIKeyINTBBYPPVQFBMT-GJJFRISPSA-N
XLogP36.77
TPSA564.38 Ų
H-Bond Donors12
H-Bond Acceptors50
Rotatable Bonds64
Heavy Atoms251
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003537.26
LogP ≤ 536.77
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1050

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline?
The IUPAC name of bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline (CID 167591899) is bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline.
What is the SMILES notation for bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline?
The canonical SMILES for bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline is CC(C)Cc1cccn([C@@H]2CCCN(CCC#N)C2)c1=O.CC(C)Cc1cccn([C@H]2CCCN(CCC#N)C2)c1=O.CC(C)Nc1cc(F)cc(F)c1F.CC(C)Nc1cc(F)ccc1F.CC(C)Nc1cc(F)cnc1OC1CC1.CC(C)Nc1cc(F)cnc1OC1CC1.CC(C)Nc1cc(N2CCCC2)nc(C(F)(F)F)c1.CC(C)Nc1cccn([C@@H]2CCN(CCC#N)C2)c1=O.CC(C)Nc1cccn([C@H]2CCN(CCC#N)C2)c1=O.CC(C)Nc1cccnc1OC(F)(F)F.CC(C)Nc1cccnc1OC(F)F.CC(C)Nc1cccnc1OC1CN(CC(F)(F)F)C1.COCCOc1ncc(F)cc1NC(C)C.COCCOc1ncccc1NC(C)C.COCCn1cccc(CC(C)C)c1=O.
What is the InChIKey of bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline?
The InChIKey is INTBBYPPVQFBMT-GJJFRISPSA-N. The full InChI is InChI=1S/2C17H25N3O.2C15H22N4O.C13H18F3N3O.C13H18F3N3.C12H19NO2.C11H17FN2O2.2C11H15FN2O.C11H18N2O2.C9H11F3N2O.C9H10F3N.C9H12F2N2O.C9H11F2N/c2*1-14(2)12-15-6-3-11-20(17(15)21)16-7-4-9-19(13-16)10-5-8-18;2*1-12(2)17-14-5-3-9-19(15(14)20)13-6-10-18(11-13)8-4-7-16;1-9(2)18-11-4-3-5-17-12(11)20-10-6-19(7-10)8-13(14,15)16;1-9(2)17-10-7-11(13(14,15)16)18-12(8-10)19-5-3-4-6-19;1-10(2)9-11-5-4-6-13(12(11)14)7-8-15-3;1-8(2)14-10-6-9(12)7-13-11(10)16-5-4-15-3;2*1-7(2)14-10-5-8(12)6-13-11(10)15-9-3-4-9;1-9(2)13-10-5-4-6-12-11(10)15-8-7-14-3;1-6(2)14-7-4-3-5-13-8(7)15-9(10,11)12;1-5(2)13-8-4-6(10)3-7(11)9(8)12;1-6(2)13-7-4-3-5-12-8(7)14-9(10)11;1-6(2)12-9-5-7(10)3-4-8(9)11/h2*3,6,11,14,16H,4-5,7,9-10,12-13H2,1-2H3;2*3,5,9,12-13,17H,4,6,8,10-11H2,1-2H3;3-5,9-10,18H,6-8H2,1-2H3;7-9H,3-6H2,1-2H3,(H,17,18);4-6,10H,7-9H2,1-3H3;6-8,14H,4-5H2,1-3H3;2*5-7,9,14H,3-4H2,1-2H3;4-6,9,13H,7-8H2,1-3H3;3-6,14H,1-2H3;3-5,13H,1-2H3;3-6,9,13H,1-2H3;3-6,12H,1-2H3/t2*16-;2*13-;;;;;;;;;;;/m1010.........../s1.
What are the key properties of bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline?
bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline has a molecular weight of 3537.26 g/mol, XLogP of 36.77, 64 rotatable bonds, 12 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2-(difluoromethoxy)-N-propan-2-ylpyridin-3-amine;2,5-difluoro-N-propan-2-ylaniline;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;3-[(3R)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3S)-3-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]piperidin-1-yl]propanenitrile;3-[(3R)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;3-[(3S)-3-[2-oxo-3-(propan-2-ylamino)-1-pyridinyl]pyrrolidin-1-yl]propanenitrile;N-propan-2-yl-2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine;N-propan-2-yl-2-[1-(2,2,2-trifluoroethyl)azetidin-3-yl]oxypyridin-3-amine;N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine;2,3,5-trifluoro-N-propan-2-ylaniline is sourced from PubChem (CID 167591899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).