N-tert-butyl-2-methoxypyridin-3-amine;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-[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

C143H202F19N27O13 — CID 159008563

IUPACN-tert-butyl-2-methoxypyridin-3-amine;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-[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)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)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.COc1ncccc1NC(C)(C)C
InChIInChI=1S/C15H22N4O.C13H18F3N3O.C13H18F3N3.C12H19NO2.C11H17FN2O2.2C11H15FN2O.C11H18N2O2.C10H16N2O.C9H11F3N2O.C9H10F3N.C9H12F2N2O.C9H11F2N/c1-12(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;1-10(2,3)12-8-6-5-7-11-9(8)13-4;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/h3,5,9,12-13,17H,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;5-7,12H,1-4H3;3-6,14H,1-2H3;3-5,13H,1-2H3;3-6,9,13H,1-2H3;3-6,12H,1-2H3/t13-;;;;;;;;;;;;/m1............/s1
InChIKeyJSFNEWZJRNPBCV-BUFWPQSASA-N
MW2868.33 g/mol
LogP32.04
Rot. Bonds51

About N-tert-butyl-2-methoxypyridin-3-amine;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-[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

N-tert-butyl-2-methoxypyridin-3-amine;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-[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 159008563) has the molecular formula C143H202F19N27O13 and a molecular weight of 2868.33 g/mol. Its IUPAC name is N-tert-butyl-2-methoxypyridin-3-amine;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-[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 NameN-tert-butyl-2-methoxypyridin-3-amine;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-[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 CID159008563
Molecular FormulaC143H202F19N27O13
Molecular Weight2868.33 g/mol
Exact Mass2866.57
IUPAC NameN-tert-butyl-2-methoxypyridin-3-amine;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-[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)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)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.COc1ncccc1NC(C)(C)C
InChIInChI=1S/C15H22N4O.C13H18F3N3O.C13H18F3N3.C12H19NO2.C11H17FN2O2.2C11H15FN2O.C11H18N2O2.C10H16N2O.C9H11F3N2O.C9H10F3N.C9H12F2N2O.C9H11F2N/c1-12(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;1-10(2,3)12-8-6-5-7-11-9(8)13-4;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/h3,5,9,12-13,17H,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;5-7,12H,1-4H3;3-6,14H,1-2H3;3-5,13H,1-2H3;3-6,9,13H,1-2H3;3-6,12H,1-2H3/t13-;;;;;;;;;;;;/m1............/s1
InChIKeyJSFNEWZJRNPBCV-BUFWPQSASA-N
XLogP32.04
TPSA439.41 Ų
H-Bond Donors12
H-Bond Acceptors40
Rotatable Bonds51
Heavy Atoms202
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002868.33
LogP ≤ 532.04
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

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

Analyze N-tert-butyl-2-methoxypyridin-3-amine;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-[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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Launch Full Analysis

Related Compounds

N-tert-butyl-2-(difluoromethoxy)pyridin-3-amine;N-tert-butyl-5-fluoro-2-methoxypyridin-3-amine;N-tert-butyl-2-(2-methoxyethoxy)pyridin-3-amine;N-tert-butyl-2-methoxypyridin-3-amine;bis(2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine);2,5-difluoro-N-propan-2-ylaniline;3-(2,2-dimethylpropyl)-1-(5-methoxy-2-pyridinyl)pyridin-2-one;5-fluoro-2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(3-fluoro-5-methoxy-2-pyridinyl)-3-(2-methylpropyl)pyridin-2-one;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;2-methoxy-N-propan-2-ylpyridin-3-amine;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 159001414
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;5-fluoro-2-methoxy-N-propan-2-ylpyridin-3-amine;1-(3-fluoro-5-methoxy-2-pyridinyl)-3-(2-methylpropyl)pyridin-2-one;2-(2-methoxyethoxy)-N-propan-2-ylpyridin-3-amine;1-(2-methoxyethyl)-3-(2-methylpropyl)pyridin-2-one;bis(2-methoxy-N-propan-2-ylpyridin-3-amine);1-(5-methoxy-2-pyridinyl)-3-(2-methylpropyl)pyridin-2-one;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
CID 158599193
1-(3-fluoro-5-methoxy-2-pyridinyl)-3-(2-methylpropyl)pyridin-2-one;1-[(1S,2R)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3R)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3R)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,2R)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2R)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(3S,4S)-3-methoxyoxan-4-yl]-3-(2-methylpropyl)pyridin-2-one;2-methoxy-N-propan-2-ylpyridin-3-amine;bis(1-(5-methoxy-2-pyridinyl)-3-(2-methylpropyl)pyridin-2-one);2-[(3R)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine
CID 159320763
bis(2-cyclopropyloxy-5-methyl-N-propan-2-ylpyridin-3-amine);2-(1,1-difluoroethyl)-N-propan-2-ylpyridin-3-amine;1-(4,4-dimethyl-5H-1,3-thiazol-2-yl)-3-(2-methylpropyl)pyridin-2-one;1-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(2-methylpropyl)pyridin-2-one;2-(2-methoxyethoxy)-5-methyl-3-(2-methylpropyl)pyridine;2-methoxy-5-methyl-N-propan-2-ylpyridin-3-amine;5-methyl-1,3-di(propan-2-yl)pyrrolo[2,3-b]pyridine;6-methyl-4-(2-methylpropyl)-2-(1-methylpyrazol-4-yl)pyridazin-3-one;5-methyl-3-(2-methylpropyl)-1-(1-methylpyrazol-3-yl)pyridin-2-one;bis(5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine);3-(2-methylpropyl)-1-(1,4,5-trimethylpyrazol-3-yl)pyridin-2-one
CID 163496963
1-(2-methoxyethyl)-3-(propan-2-ylamino)pyridin-2-one
CID 139373358
2-cyclopropyloxy-5-fluoro-N-propan-2-ylpyridin-3-amine
CID 139373359
N-propan-2-yl-2-(trifluoromethoxy)pyridin-3-amine
CID 139373371
1-[1-[2-[5-(2,3-difluorophenyl)-1-(2-methoxyethyl)-2-oxo-3-pyridinyl]acetyl]piperidin-4-yl]-3H-imidazo[4,5-b]pyridin-2-one
CID 59825893
1-[(1R,3R)-3-methoxycyclohexyl]-3-(propan-2-ylamino)pyridin-2-one
CID 137457664
3-[2-[4-[[6-[3-[(3-ethoxy-2-pyridinyl)oxy]piperidin-1-yl]pyrazin-2-yl]amino]-3-fluoro-2-pyridinyl]-4-fluorophenyl]-2,2-dimethylpropanoic acid
CID 175790985
2-(azepan-1-yl)-N-(2,5-difluorophenyl)pyridine-3-carboxamide
CID 84576375
1-(4-methoxycyclohexyl)-3-(propan-2-ylamino)pyridin-2-one
CID 137449049

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-methoxypyridin-3-amine;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-[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 N-tert-butyl-2-methoxypyridin-3-amine;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-[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 159008563) is N-tert-butyl-2-methoxypyridin-3-amine;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-[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 N-tert-butyl-2-methoxypyridin-3-amine;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-[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 N-tert-butyl-2-methoxypyridin-3-amine;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-[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)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)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.COc1ncccc1NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-methoxypyridin-3-amine;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-[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 JSFNEWZJRNPBCV-BUFWPQSASA-N. The full InChI is InChI=1S/C15H22N4O.C13H18F3N3O.C13H18F3N3.C12H19NO2.C11H17FN2O2.2C11H15FN2O.C11H18N2O2.C10H16N2O.C9H11F3N2O.C9H10F3N.C9H12F2N2O.C9H11F2N/c1-12(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;1-10(2,3)12-8-6-5-7-11-9(8)13-4;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/h3,5,9,12-13,17H,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;5-7,12H,1-4H3;3-6,14H,1-2H3;3-5,13H,1-2H3;3-6,9,13H,1-2H3;3-6,12H,1-2H3/t13-;;;;;;;;;;;;/m1............/s1.
What are the key properties of N-tert-butyl-2-methoxypyridin-3-amine;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-[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?
N-tert-butyl-2-methoxypyridin-3-amine;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-[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 2868.33 g/mol, XLogP of 32.04, 51 rotatable bonds, 12 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-methoxypyridin-3-amine;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-[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 159008563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).