5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine

C241H347ClF4N40O3 — CID 159257936

IUPAC5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine
SMILESCC(C)c1cc[nH]c1.CC(C)c1ccc(C(F)(F)F)cn1.CC(C)c1ccc(Cl)cn1.CC(C)c1ccc(F)cn1.CC(C)c1ccc(N(C)C)nc1.CC(C)c1ccc(N)nc1.CC(C)c1ccc(N=[N+]=[N-])cn1.CC(C)c1ccc[nH]1.CC(C)c1cccc(N)n1.CC(C)c1ccccn1.CC(C)c1cccn1C.CC(C)c1cccnc1.CC(C)c1ccn(C)c1.CC(C)c1ccncc1.CC(C)c1ccncn1.CC(C)c1cnccn1.CC(C)c1cncnc1.CC(C)c1ncccn1.CCc1ccnc(C(C)C)c1.COc1ccc(C(C)C)cn1.COc1ccc(C(C)C)nc1.COc1cccc(C(C)C)n1.Cc1cc(C(C)C)cnc1N.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1cccc(C(C)C)n1.Cc1cccc(C(C)C)n1.Cc1cccnc1C(C)C.Cc1ccnc(C(C)C)c1
InChIInChI=1S/C10H16N2.C10H15N.C9H10F3N.C9H14N2.3C9H13NO.6C9H13N.C8H10ClN.C8H10FN.C8H10N4.2C8H12N2.2C8H13N.3C8H11N.4C7H10N2.2C7H11N/c1-8(2)9-5-6-10(11-7-9)12(3)4;1-4-9-5-6-11-10(7-9)8(2)3;1-6(2)8-4-3-7(5-13-8)9(10,11)12;1-6(2)8-4-7(3)9(10)11-5-8;1-7(2)9-5-4-8(11-3)6-10-9;1-7(2)8-4-5-9(11-3)10-6-8;1-7(2)8-5-4-6-9(10-8)11-3;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-8(3)5-4-6-10-9;2*1-7(2)9-6-4-5-8(3)10-9;2*1-6(2)8-4-3-7(9)5-10-8;1-6(2)8-4-3-7(5-10-8)11-12-9;1-6(2)7-3-4-8(9)10-5-7;1-6(2)7-4-3-5-8(9)10-7;1-7(2)8-4-5-9(3)6-8;1-7(2)8-5-4-6-9(8)3;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-5-9-7;1-6(2)7-8-4-3-5-9-7;1-6(2)7-3-4-8-5-7;1-6(2)7-4-3-5-8-7/h5-8H,1-4H3;5-8H,4H2,1-3H3;3-6H,1-2H3;4-6H,1-3H3,(H2,10,11);3*4-7H,1-3H3;6*4-7H,1-3H3;2*3-6H,1-2H3;3-6H,1-2H3;2*3-6H,1-2H3,(H2,9,10);2*4-7H,1-3H3;3*3-7H,1-2H3;4*3-6H,1-2H3;2*3-6,8H,1-2H3
InChIKeyKWDIDNYLYQYDKN-UHFFFAOYSA-N
MW3964.15 g/mol
LogP65.59
Rot. Bonds35

About 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine

5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine (PubChem CID 159257936) has the molecular formula C241H347ClF4N40O3 and a molecular weight of 3964.15 g/mol. Its IUPAC name is 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine
PubChem CID159257936
Molecular FormulaC241H347ClF4N40O3
Molecular Weight3964.15 g/mol
Exact Mass3960.79
IUPAC Name5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine
SMILESCC(C)c1cc[nH]c1.CC(C)c1ccc(C(F)(F)F)cn1.CC(C)c1ccc(Cl)cn1.CC(C)c1ccc(F)cn1.CC(C)c1ccc(N(C)C)nc1.CC(C)c1ccc(N)nc1.CC(C)c1ccc(N=[N+]=[N-])cn1.CC(C)c1ccc[nH]1.CC(C)c1cccc(N)n1.CC(C)c1ccccn1.CC(C)c1cccn1C.CC(C)c1cccnc1.CC(C)c1ccn(C)c1.CC(C)c1ccncc1.CC(C)c1ccncn1.CC(C)c1cnccn1.CC(C)c1cncnc1.CC(C)c1ncccn1.CCc1ccnc(C(C)C)c1.COc1ccc(C(C)C)cn1.COc1ccc(C(C)C)nc1.COc1cccc(C(C)C)n1.Cc1cc(C(C)C)cnc1N.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1cccc(C(C)C)n1.Cc1cccc(C(C)C)n1.Cc1cccnc1C(C)C.Cc1ccnc(C(C)C)c1
InChIInChI=1S/C10H16N2.C10H15N.C9H10F3N.C9H14N2.3C9H13NO.6C9H13N.C8H10ClN.C8H10FN.C8H10N4.2C8H12N2.2C8H13N.3C8H11N.4C7H10N2.2C7H11N/c1-8(2)9-5-6-10(11-7-9)12(3)4;1-4-9-5-6-11-10(7-9)8(2)3;1-6(2)8-4-3-7(5-13-8)9(10,11)12;1-6(2)8-4-7(3)9(10)11-5-8;1-7(2)9-5-4-8(11-3)6-10-9;1-7(2)8-4-5-9(11-3)10-6-8;1-7(2)8-5-4-6-9(10-8)11-3;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-8(3)5-4-6-10-9;2*1-7(2)9-6-4-5-8(3)10-9;2*1-6(2)8-4-3-7(9)5-10-8;1-6(2)8-4-3-7(5-10-8)11-12-9;1-6(2)7-3-4-8(9)10-5-7;1-6(2)7-4-3-5-8(9)10-7;1-7(2)8-4-5-9(3)6-8;1-7(2)8-5-4-6-9(8)3;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-5-9-7;1-6(2)7-8-4-3-5-9-7;1-6(2)7-3-4-8-5-7;1-6(2)7-4-3-5-8-7/h5-8H,1-4H3;5-8H,4H2,1-3H3;3-6H,1-2H3;4-6H,1-3H3,(H2,10,11);3*4-7H,1-3H3;6*4-7H,1-3H3;2*3-6H,1-2H3;3-6H,1-2H3;2*3-6H,1-2H3,(H2,9,10);2*4-7H,1-3H3;3*3-7H,1-2H3;4*3-6H,1-2H3;2*3-6,8H,1-2H3
InChIKeyKWDIDNYLYQYDKN-UHFFFAOYSA-N
XLogP65.59
TPSA573.00 Ų
H-Bond Donors5
H-Bond Acceptors39
Rotatable Bonds35
Heavy Atoms289
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003964.15
LogP ≤ 565.59
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Analyze 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine with MolForge

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Related Compounds

US11420970, Example 224
CID 156073274
US11420970, Example 243
CID 156073389
[1-[3-[3-(4-chloro-5-fluoro-1H-pyrrolo[2,3-b]pyridin-2-yl)-5,6-dimethoxypyrrolo[3,2-b]pyridin-1-yl]propyl]piperidin-4-yl]methanamine
CID 68467160
2-[amino-[1-[2-[3-(4-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-5,6-dimethoxypyrrolo[3,2-b]pyridin-1-yl]ethyl]piperidin-4-yl]methyl]-1-[3-[3-(4-chloro-5-fluoro-1H-pyrrolo[2,3-b]pyridin-2-yl)-5,6-dimethoxypyrrolo[3,2-b]pyridin-1-yl]propyl]piperidin-4-ol
CID 87462719
1-[3-[3-(4-chloro-5-fluoro-1H-pyrrolo[2,3-b]pyridin-2-yl)-5,6-dimethoxypyrrolo[3,2-b]pyridin-1-yl]propyl]-3-[[1-[2-[3-(4-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-5,6-dimethoxypyrrolo[3,2-b]pyridin-1-yl]ethyl]piperidin-4-yl]methylamino]piperidin-4-ol
CID 87462720
3-[6-(4-chlorophenyl)pyrazin-2-yl]-6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridine;6-[6-methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylpyrazin-2-amine
CID 118094799
8-methoxy-6-[5-[4-methyl-5-(1-methylpiperidin-4-yl)-2-pyridinyl]-4-(2,2,2-trifluoroethyl)-1H-pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridine
CID 156321611
1-(5-Chloro-2-pyridinyl)-2-[14-(fluoromethyl)-6,10,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),11(16),12,14-tetraen-10-yl]ethanol;1-[14-(fluoromethyl)-6,10,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),11(16),12,14-tetraen-10-yl]-2-[6-(trifluoromethyl)-3-pyridinyl]propan-2-ol;1-(14-fluoro-6,10,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),11(16),12,14-tetraen-10-yl)-2-(6-methoxy-3-pyridinyl)propan-2-ol;2-(14-methyl-6,10,13,15-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),11,13,15-tetraen-10-yl)-1-pyridin-4-ylethanol
CID 157800002
2-(6-chloro-2-methylimidazo[4,5-b]pyridin-1-yl)-4-N-[4-(difluoromethoxy)-3-fluorophenyl]-5-fluoropyrimidine-4,6-diamine;2-(6-chloro-2-methylimidazo[4,5-b]pyridin-1-yl)-4-N-[4-(difluoromethoxy)phenyl]-5-fluoropyrimidine-4,6-diamine;2-(6-chloro-2-methylimidazo[4,5-b]pyridin-1-yl)-5-fluoro-4-N-[4-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine;4-N-[4-(difluoromethoxy)phenyl]-5-fluoro-2-(5-fluoro-2-methylbenzimidazol-1-yl)pyrimidine-4,6-diamine
CID 157977837
12-(4-Chlorophenyl)-3-(1-ethylpiperidin-4-yl)oxy-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;12-[4-[(4,4-difluoropiperidin-1-yl)methyl]phenyl]-3-(1-ethylpiperidin-4-yl)oxy-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-(1-ethylpiperidin-4-yl)oxy-12-(6-methoxy-3-pyridinyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-(1-ethylpiperidin-4-yl)oxy-12-pyridin-3-yl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile;3-(1-ethylpiperidin-4-yl)oxy-12-[4-[[4-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene-4-carbonitrile
CID 158009848
1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(5-methoxy-2-pyridinyl)indole;1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(5-methoxypyrimidin-2-yl)indole;5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-1-(3-pyridin-2-ylpropyl)-3-[4-(trifluoromethoxy)phenyl]indole;N-[4-[5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]butyl]pyridin-2-amine;N-[4-[5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]butyl]-N-pyridin-2-ylpyridin-2-amine
CID 158102531
3-chloro-5-[2-[(3S)-3-fluoro-3-methylpyrrolidin-1-yl]-6-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrimidin-4-yl]pyridin-2-amine;3-(difluoromethoxy)-5-[2-(3,3-difluoropyrrolidin-1-yl)-6-(6-oxa-3-azabicyclo[3.1.1]heptan-3-yl)pyrimidin-4-yl]pyridin-2-amine;bis(3-(difluoromethoxy)-5-[2-(3-fluoro-4-methylpyrrolidin-1-yl)-6-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrimidin-4-yl]pyridin-2-amine);3-fluoro-5-[2-(3-fluoro-3-methylpyrrolidin-1-yl)-6-[(1S,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]pyrimidin-4-yl]pyridin-2-amine
CID 158672028

Frequently Asked Questions

What is the IUPAC name of 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine?
The IUPAC name of 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine (CID 159257936) is 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine?
The canonical SMILES for 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine is CC(C)c1cc[nH]c1.CC(C)c1ccc(C(F)(F)F)cn1.CC(C)c1ccc(Cl)cn1.CC(C)c1ccc(F)cn1.CC(C)c1ccc(N(C)C)nc1.CC(C)c1ccc(N)nc1.CC(C)c1ccc(N=[N+]=[N-])cn1.CC(C)c1ccc[nH]1.CC(C)c1cccc(N)n1.CC(C)c1ccccn1.CC(C)c1cccn1C.CC(C)c1cccnc1.CC(C)c1ccn(C)c1.CC(C)c1ccncc1.CC(C)c1ccncn1.CC(C)c1cnccn1.CC(C)c1cncnc1.CC(C)c1ncccn1.CCc1ccnc(C(C)C)c1.COc1ccc(C(C)C)cn1.COc1ccc(C(C)C)nc1.COc1cccc(C(C)C)n1.Cc1cc(C(C)C)cnc1N.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1cccc(C(C)C)n1.Cc1cccc(C(C)C)n1.Cc1cccnc1C(C)C.Cc1ccnc(C(C)C)c1.
What is the InChIKey of 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine?
The InChIKey is KWDIDNYLYQYDKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2.C10H15N.C9H10F3N.C9H14N2.3C9H13NO.6C9H13N.C8H10ClN.C8H10FN.C8H10N4.2C8H12N2.2C8H13N.3C8H11N.4C7H10N2.2C7H11N/c1-8(2)9-5-6-10(11-7-9)12(3)4;1-4-9-5-6-11-10(7-9)8(2)3;1-6(2)8-4-3-7(5-13-8)9(10,11)12;1-6(2)8-4-7(3)9(10)11-5-8;1-7(2)9-5-4-8(11-3)6-10-9;1-7(2)8-4-5-9(11-3)10-6-8;1-7(2)8-5-4-6-9(10-8)11-3;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-8(3)5-4-6-10-9;2*1-7(2)9-6-4-5-8(3)10-9;2*1-6(2)8-4-3-7(9)5-10-8;1-6(2)8-4-3-7(5-10-8)11-12-9;1-6(2)7-3-4-8(9)10-5-7;1-6(2)7-4-3-5-8(9)10-7;1-7(2)8-4-5-9(3)6-8;1-7(2)8-5-4-6-9(8)3;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-5-9-7;1-6(2)7-8-4-3-5-9-7;1-6(2)7-3-4-8-5-7;1-6(2)7-4-3-5-8-7/h5-8H,1-4H3;5-8H,4H2,1-3H3;3-6H,1-2H3;4-6H,1-3H3,(H2,10,11);3*4-7H,1-3H3;6*4-7H,1-3H3;2*3-6H,1-2H3;3-6H,1-2H3;2*3-6H,1-2H3,(H2,9,10);2*4-7H,1-3H3;3*3-7H,1-2H3;4*3-6H,1-2H3;2*3-6,8H,1-2H3.
What are the key properties of 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine?
5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine has a molecular weight of 3964.15 g/mol, XLogP of 65.59, 35 rotatable bonds, 5 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 5-azido-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,N-dimethyl-5-propan-2-ylpyridin-2-amine;4-ethyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;bis(2-methyl-6-propan-2-ylpyridine);3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;1-methyl-3-propan-2-ylpyrrole;2-propan-2-ylpyrazine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;3-propan-2-yl-1H-pyrrole;2-propan-2-yl-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 159257936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).