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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol

C121H176ClF5N22O11S — CID 159244768

IUPAC4-(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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol
SMILESCC(C)c1cc(C(F)(F)F)nn1C.CC(C)c1ccc(C(C)(C)O)cn1.CC(C)c1ccc(N2CCC(O)CC2)cn1.CC(C)c1ccc(N2CCNC(=O)C2)nc1.CC(C)c1ccc(N2CCOCC2)nc1.CC(C)c1cnccc1C(N)=O.CC(C)c1ncc(Cl)cc1N1CCOCC1.CC(C)c1ncc(N2CCC(O)CC2)cc1F.CC(C)c1ncc(N2CCOCC2)cc1F.Cc1cc(C(N)=O)c(C(C)C)cn1.Cc1ncc(C(C)C)c(S(C)(=O)=O)n1
InChIInChI=1S/C13H19FN2O.C13H20N2O.C12H17ClN2O.C12H17FN2O.C12H17N3O.C12H18N2O.C11H17NO.C10H14N2O.C9H14N2O2S.C9H12N2O.C8H11F3N2/c1-9(2)13-12(14)7-10(8-15-13)16-5-3-11(17)4-6-16;1-10(2)13-4-3-11(9-14-13)15-7-5-12(16)6-8-15;1-9(2)12-11(7-10(13)8-14-12)15-3-5-16-6-4-15;1-9(2)12-11(13)7-10(8-14-12)15-3-5-16-6-4-15;1-9(2)10-3-4-11(14-7-10)15-6-5-13-12(16)8-15;1-10(2)11-3-4-12(13-9-11)14-5-7-15-8-6-14;1-8(2)10-6-5-9(7-12-10)11(3,4)13;1-6(2)9-5-12-7(3)4-8(9)10(11)13;1-6(2)8-5-10-7(3)11-9(8)14(4,12)13;1-6(2)8-5-11-4-3-7(8)9(10)12;1-5(2)6-4-7(8(9,10)11)12-13(6)3/h7-9,11,17H,3-6H2,1-2H3;3-4,9-10,12,16H,5-8H2,1-2H3;2*7-9H,3-6H2,1-2H3;3-4,7,9H,5-6,8H2,1-2H3,(H,13,16);3-4,9-10H,5-8H2,1-2H3;5-8,13H,1-4H3;4-6H,1-3H3,(H2,11,13);5-6H,1-4H3;3-6H,1-2H3,(H2,10,12);4-5H,1-3H3
InChIKeyKUNSOLGUBXPKFZ-UHFFFAOYSA-N
MW2277.39 g/mol
LogP21.75
Rot. Bonds21

About 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol

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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol (PubChem CID 159244768) has the molecular formula C121H176ClF5N22O11S and a molecular weight of 2277.39 g/mol. Its IUPAC name is 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name4-(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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol
PubChem CID159244768
Molecular FormulaC121H176ClF5N22O11S
Molecular Weight2277.39 g/mol
Exact Mass2275.32
IUPAC Name4-(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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol
SMILESCC(C)c1cc(C(F)(F)F)nn1C.CC(C)c1ccc(C(C)(C)O)cn1.CC(C)c1ccc(N2CCC(O)CC2)cn1.CC(C)c1ccc(N2CCNC(=O)C2)nc1.CC(C)c1ccc(N2CCOCC2)nc1.CC(C)c1cnccc1C(N)=O.CC(C)c1ncc(Cl)cc1N1CCOCC1.CC(C)c1ncc(N2CCC(O)CC2)cc1F.CC(C)c1ncc(N2CCOCC2)cc1F.Cc1cc(C(N)=O)c(C(C)C)cn1.Cc1ncc(C(C)C)c(S(C)(=O)=O)n1
InChIInChI=1S/C13H19FN2O.C13H20N2O.C12H17ClN2O.C12H17FN2O.C12H17N3O.C12H18N2O.C11H17NO.C10H14N2O.C9H14N2O2S.C9H12N2O.C8H11F3N2/c1-9(2)13-12(14)7-10(8-15-13)16-5-3-11(17)4-6-16;1-10(2)13-4-3-11(9-14-13)15-7-5-12(16)6-8-15;1-9(2)12-11(7-10(13)8-14-12)15-3-5-16-6-4-15;1-9(2)12-11(13)7-10(8-14-12)15-3-5-16-6-4-15;1-9(2)10-3-4-11(14-7-10)15-6-5-13-12(16)8-15;1-10(2)11-3-4-12(13-9-11)14-5-7-15-8-6-14;1-8(2)10-6-5-9(7-12-10)11(3,4)13;1-6(2)9-5-12-7(3)4-8(9)10(11)13;1-6(2)8-5-10-7(3)11-9(8)14(4,12)13;1-6(2)8-5-11-4-3-7(8)9(10)12;1-5(2)6-4-7(8(9,10)11)12-13(6)3/h7-9,11,17H,3-6H2,1-2H3;3-4,9-10,12,16H,5-8H2,1-2H3;2*7-9H,3-6H2,1-2H3;3-4,7,9H,5-6,8H2,1-2H3,(H,13,16);3-4,9-10H,5-8H2,1-2H3;5-8,13H,1-4H3;4-6H,1-3H3,(H2,11,13);5-6H,1-4H3;3-6H,1-2H3,(H2,10,12);4-5H,1-3H3
InChIKeyKUNSOLGUBXPKFZ-UHFFFAOYSA-N
XLogP21.75
TPSA416.85 Ų
H-Bond Donors6
H-Bond Acceptors30
Rotatable Bonds21
Heavy Atoms161
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002277.39
LogP ≤ 521.75
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1030

Analyze 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol?
The IUPAC name of 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol (CID 159244768) is 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol.
What is the SMILES notation for 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol?
The canonical SMILES for 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol is CC(C)c1cc(C(F)(F)F)nn1C.CC(C)c1ccc(C(C)(C)O)cn1.CC(C)c1ccc(N2CCC(O)CC2)cn1.CC(C)c1ccc(N2CCNC(=O)C2)nc1.CC(C)c1ccc(N2CCOCC2)nc1.CC(C)c1cnccc1C(N)=O.CC(C)c1ncc(Cl)cc1N1CCOCC1.CC(C)c1ncc(N2CCC(O)CC2)cc1F.CC(C)c1ncc(N2CCOCC2)cc1F.Cc1cc(C(N)=O)c(C(C)C)cn1.Cc1ncc(C(C)C)c(S(C)(=O)=O)n1.
What is the InChIKey of 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol?
The InChIKey is KUNSOLGUBXPKFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O.C13H20N2O.C12H17ClN2O.C12H17FN2O.C12H17N3O.C12H18N2O.C11H17NO.C10H14N2O.C9H14N2O2S.C9H12N2O.C8H11F3N2/c1-9(2)13-12(14)7-10(8-15-13)16-5-3-11(17)4-6-16;1-10(2)13-4-3-11(9-14-13)15-7-5-12(16)6-8-15;1-9(2)12-11(7-10(13)8-14-12)15-3-5-16-6-4-15;1-9(2)12-11(13)7-10(8-14-12)15-3-5-16-6-4-15;1-9(2)10-3-4-11(14-7-10)15-6-5-13-12(16)8-15;1-10(2)11-3-4-12(13-9-11)14-5-7-15-8-6-14;1-8(2)10-6-5-9(7-12-10)11(3,4)13;1-6(2)9-5-12-7(3)4-8(9)10(11)13;1-6(2)8-5-10-7(3)11-9(8)14(4,12)13;1-6(2)8-5-11-4-3-7(8)9(10)12;1-5(2)6-4-7(8(9,10)11)12-13(6)3/h7-9,11,17H,3-6H2,1-2H3;3-4,9-10,12,16H,5-8H2,1-2H3;2*7-9H,3-6H2,1-2H3;3-4,7,9H,5-6,8H2,1-2H3,(H,13,16);3-4,9-10H,5-8H2,1-2H3;5-8,13H,1-4H3;4-6H,1-3H3,(H2,11,13);5-6H,1-4H3;3-6H,1-2H3,(H2,10,12);4-5H,1-3H3.
What are the key properties of 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol?
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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol has a molecular weight of 2277.39 g/mol, XLogP of 21.75, 21 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 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;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;3-propan-2-ylpyridine-4-carboxamide;4-(5-propan-2-yl-2-pyridinyl)morpholine;4-(5-propan-2-yl-2-pyridinyl)piperazin-2-one;1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol is sourced from PubChem (CID 159244768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).