4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine

C220H410N34O9 — CID 160797020

IUPAC4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine
SMILESCC(=O)N1CCN(C(C)C)CC1.CC(=O)N1CCN(C(C)C)CC1C.CC(C)(C)N1CCCC(Oc2ccccc2)C1.CC(C)(C)N1CCN(Cc2cccnc2)CC1.CC(C)N1CCC(CN(C)C)CC1.CC(C)N1CCC(N(C)C)CC1.CC(C)N1CCC(c2ccccc2)C1.CC(C)N1CCCC(O)C1.CC(C)N1CCCC(c2ccccc2)C1.CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCCC[C@@H]1C.CC(C)N1CCCN(C)CC1.CC(C)N1CCN(C(=O)OC(C)(C)C)CC1.CC(C)N1CCNC(=O)C1.CC(C)N1CCNCC1.CC(C)N1CCOCC1.CC(C)N1CCc2[nH]ncc2C1.CC(C)N1C[C@@H]2C[C@H]1CN2Cc1ccccc1.CC1CN(C(C)C)CC(C)C1Cc1ccccc1.CC1CN(C(C)C)CC(C)O1
InChIInChI=1S/C17H27N.C15H22N2.C15H23NO.C14H23N3.C14H21N.C13H19N.C12H24N2O2.C11H24N2.C10H20N2O.C10H22N2.C9H15N3.C9H18N2O.C9H20N2.C9H19NO.C9H19N.C8H17NO.C8H17N.C7H14N2O.C7H16N2.C7H15NO.C7H15N/c1-13(2)18-11-14(3)17(15(4)12-18)10-16-8-6-5-7-9-16;1-12(2)17-11-14-8-15(17)10-16(14)9-13-6-4-3-5-7-13;1-15(2,3)16-11-7-10-14(12-16)17-13-8-5-4-6-9-13;1-14(2,3)17-9-7-16(8-10-17)12-13-5-4-6-15-11-13;1-12(2)15-10-6-9-14(11-15)13-7-4-3-5-8-13;1-11(2)14-9-8-13(10-14)12-6-4-3-5-7-12;1-10(2)13-6-8-14(9-7-13)11(15)16-12(3,4)5;1-10(2)13-7-5-11(6-8-13)9-12(3)4;1-8(2)11-5-6-12(10(4)13)9(3)7-11;1-9(2)12-7-5-10(6-8-12)11(3)4;1-7(2)12-4-3-9-8(6-12)5-10-11-9;1-8(2)10-4-6-11(7-5-10)9(3)12;1-9(2)11-6-4-5-10(3)7-8-11;1-7(2)10-5-8(3)11-9(4)6-10;1-8(2)10-7-5-4-6-9(10)3;1-7(2)9-5-3-4-8(10)6-9;1-8(2)9-6-4-3-5-7-9;1-6(2)9-4-3-8-7(10)5-9;1-7(2)9-5-3-8-4-6-9;1-7(2)8-3-5-9-6-4-8;1-7(2)8-5-3-4-6-8/h5-9,13-15,17H,10-12H2,1-4H3;3-7,12,14-15H,8-11H2,1-2H3;4-6,8-9,14H,7,10-12H2,1-3H3;4-6,11H,7-10,12H2,1-3H3;3-5,7-8,12,14H,6,9-11H2,1-2H3;3-7,11,13H,8-10H2,1-2H3;10H,6-9H2,1-5H3;10-11H,5-9H2,1-4H3;8-9H,5-7H2,1-4H3;9-10H,5-8H2,1-4H3;5,7H,3-4,6H2,1-2H3,(H,10,11);8H,4-7H2,1-3H3;9H,4-8H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;7-8,10H,3-6H2,1-2H3;8H,3-7H2,1-2H3;6H,3-5H2,1-2H3,(H,8,10);7-8H,3-6H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3/t;14-,15-;;;;;;;;;;;;;9-;;;;;;/m.0............0....../s1
InChIKeySCONODKHGKGMTP-FCBPHKGZSA-N
MW3675.93 g/mol
LogP35.28
Rot. Bonds32

About 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine

4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine (PubChem CID 160797020) has the molecular formula C220H410N34O9 and a molecular weight of 3675.93 g/mol. Its IUPAC name is 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine.

Molecular Properties

Compound Name4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine
PubChem CID160797020
Molecular FormulaC220H410N34O9
Molecular Weight3675.93 g/mol
Exact Mass3673.27
IUPAC Name4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine
SMILESCC(=O)N1CCN(C(C)C)CC1.CC(=O)N1CCN(C(C)C)CC1C.CC(C)(C)N1CCCC(Oc2ccccc2)C1.CC(C)(C)N1CCN(Cc2cccnc2)CC1.CC(C)N1CCC(CN(C)C)CC1.CC(C)N1CCC(N(C)C)CC1.CC(C)N1CCC(c2ccccc2)C1.CC(C)N1CCCC(O)C1.CC(C)N1CCCC(c2ccccc2)C1.CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCCC[C@@H]1C.CC(C)N1CCCN(C)CC1.CC(C)N1CCN(C(=O)OC(C)(C)C)CC1.CC(C)N1CCNC(=O)C1.CC(C)N1CCNCC1.CC(C)N1CCOCC1.CC(C)N1CCc2[nH]ncc2C1.CC(C)N1C[C@@H]2C[C@H]1CN2Cc1ccccc1.CC1CN(C(C)C)CC(C)C1Cc1ccccc1.CC1CN(C(C)C)CC(C)O1
InChIInChI=1S/C17H27N.C15H22N2.C15H23NO.C14H23N3.C14H21N.C13H19N.C12H24N2O2.C11H24N2.C10H20N2O.C10H22N2.C9H15N3.C9H18N2O.C9H20N2.C9H19NO.C9H19N.C8H17NO.C8H17N.C7H14N2O.C7H16N2.C7H15NO.C7H15N/c1-13(2)18-11-14(3)17(15(4)12-18)10-16-8-6-5-7-9-16;1-12(2)17-11-14-8-15(17)10-16(14)9-13-6-4-3-5-7-13;1-15(2,3)16-11-7-10-14(12-16)17-13-8-5-4-6-9-13;1-14(2,3)17-9-7-16(8-10-17)12-13-5-4-6-15-11-13;1-12(2)15-10-6-9-14(11-15)13-7-4-3-5-8-13;1-11(2)14-9-8-13(10-14)12-6-4-3-5-7-12;1-10(2)13-6-8-14(9-7-13)11(15)16-12(3,4)5;1-10(2)13-7-5-11(6-8-13)9-12(3)4;1-8(2)11-5-6-12(10(4)13)9(3)7-11;1-9(2)12-7-5-10(6-8-12)11(3)4;1-7(2)12-4-3-9-8(6-12)5-10-11-9;1-8(2)10-4-6-11(7-5-10)9(3)12;1-9(2)11-6-4-5-10(3)7-8-11;1-7(2)10-5-8(3)11-9(4)6-10;1-8(2)10-7-5-4-6-9(10)3;1-7(2)9-5-3-4-8(10)6-9;1-8(2)9-6-4-3-5-7-9;1-6(2)9-4-3-8-7(10)5-9;1-7(2)9-5-3-8-4-6-9;1-7(2)8-3-5-9-6-4-8;1-7(2)8-5-3-4-6-8/h5-9,13-15,17H,10-12H2,1-4H3;3-7,12,14-15H,8-11H2,1-2H3;4-6,8-9,14H,7,10-12H2,1-3H3;4-6,11H,7-10,12H2,1-3H3;3-5,7-8,12,14H,6,9-11H2,1-2H3;3-7,11,13H,8-10H2,1-2H3;10H,6-9H2,1-5H3;10-11H,5-9H2,1-4H3;8-9H,5-7H2,1-4H3;9-10H,5-8H2,1-4H3;5,7H,3-4,6H2,1-2H3,(H,10,11);8H,4-7H2,1-3H3;9H,4-8H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;7-8,10H,3-6H2,1-2H3;8H,3-7H2,1-2H3;6H,3-5H2,1-2H3,(H,8,10);7-8H,3-6H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3/t;14-,15-;;;;;;;;;;;;;9-;;;;;;/m.0............0....../s1
InChIKeySCONODKHGKGMTP-FCBPHKGZSA-N
XLogP35.28
TPSA285.02 Ų
H-Bond Donors4
H-Bond Acceptors38
Rotatable Bonds32
Heavy Atoms263
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003675.93
LogP ≤ 535.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1038

Analyze 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine with MolForge

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Launch Full Analysis

Related Compounds

(2R)-N-[(3R)-5-methylhexan-3-yl]-4-[(4-pyrazol-1-ylphenyl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide;methyl 2-[[4-[(4-pyrazol-1-ylphenyl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]acetate;N-methyl-4-[(4-pyrazol-1-ylphenyl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide;N-propan-2-yl-4-[(4-pyrazol-1-ylphenyl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide;4-[(4-pyrazol-1-ylphenyl)methyl]-N-(pyridin-2-ylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide
CID 157382667
1-benzyl-2,6-dimethyl-4-propan-2-ylpiperazine;N-benzyl-N-methylpropan-2-amine;1-benzyl-4-propan-2-ylpiperidine;2,3-dimethylbutan-2-ol;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;N-methyl-N-(2-phenylethyl)propan-2-amine;(2S)-2-methyl-1-propan-2-ylpiperidine;1-(1-phenylethyl)-4-propan-2-ylpyrazole;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-yloxane;propan-2-yloxycyclohexane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;propan-2-yloxycyclopentane;[(1S)-1-propan-2-yloxyethyl]benzene;4-(1-propan-2-yloxyethyl)oxane;3-(1-propan-2-yloxyethyl)pyridine;1-(3-propan-2-yloxypiperidin-1-yl)ethanone;1-propan-2-yloxypropan-2-ylbenzene;2-propan-2-yloxypropylbenzene;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine
CID 157538703
(1S,4S)-2-benzyl-5-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;1-benzyl-2,6-dimethyl-4-propan-2-ylpiperazine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine
CID 157729164
1-[2-benzyl-4-(2-methoxyphenyl)piperazin-1-yl]-2-methylpropan-1-one;tert-butyl 3-(hydroxymethyl)-4-(2-methylpropanoyl)piperazine-1-carboxylate;ethane;1-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-2-methylpropan-1-one;1-[4-(3H-indol-2-ylmethyl)-1,4-diazepan-1-yl]-2-methylpropan-1-one;2-methyl-1-[4-(3-methylpyrrolidin-1-yl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one;2-methyl-1-(3-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)propan-1-one;2-methyl-1-(6-pyridin-2-ylspiro[3.3]heptan-2-yl)propan-1-one;2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl]propan-1-one
CID 158361797
tert-butylbenzene;5-tert-butyl-2,2-dimethyloxolane;5-tert-butyl-2-methoxypyridine;3-tert-butyl-1-methylpyrazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methyl-1H-pyrazol-2-ium;4-[2-(4-tert-butylpyrazol-1-yl)ethyl]morpholine;3-tert-butylpyridine;3-[(5-tert-butyl-2-pyridinyl)oxy]-N,N-dimethylpropan-1-amine;5-tert-butyl-2-(2-pyrrolidin-1-ylethoxy)pyridine;2,2-dimethyl-1-[(2-methylpropan-2-yl)oxy]propane;1-(2,2-dimethylpropyl)-2,6-dimethylpiperidine;1-(2,2-dimethylpropyl)-2,2-dimethylpyrrolidine
CID 158806841
1-[2-benzyl-4-(2-methoxyphenyl)piperazin-1-yl]-2-methylpropan-1-one;tert-butyl 3-(hydroxymethyl)-4-(2-methylpropanoyl)piperazine-1-carboxylate;ethane;1-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-2-methylpropan-1-one;1-[4-(3H-indol-2-ylmethyl)-1,4-diazepan-1-yl]-2-methylpropan-1-one;2-methyl-1-[4-(3-methylpyrrolidin-1-yl)piperidin-1-yl]propan-1-one;2-methyl-1-(3-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)propan-1-one;2-methyl-1-(6-pyridin-2-ylspiro[3.3]heptan-2-yl)propan-1-one;2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl]propan-1-one
CID 160691294
1-benzyl-2,6-dimethyl-4-propan-2-ylpiperazine;N-benzyl-N-methylpropan-2-amine;1-benzyl-4-propan-2-ylpiperidine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;N-methyl-N-(2-phenylethyl)propan-2-amine;(2S)-2-methyl-1-propan-2-ylpiperidine;1-(1-phenylethyl)-4-propan-2-ylpyrazole;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-yloxane;propan-2-yloxycyclohexane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;propan-2-yloxycyclopentane;[(1S)-1-propan-2-yloxyethyl]benzene;4-(1-propan-2-yloxyethyl)oxane;3-(1-propan-2-yloxyethyl)pyridine;1-(3-propan-2-yloxypiperidin-1-yl)ethanone;1-propan-2-yloxypropan-2-ylbenzene;2-propan-2-yloxypropylbenzene;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine
CID 160789545
N,N-dimethyl-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propanamide;N-(2-hydroxyethyl)-N-methyl-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propanamide;N-(2-hydroxyethyl)-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propanamide;N-(1-hydroxypropan-2-yl)-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propanamide;N-(2-hydroxypropyl)-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propanamide;N-(2-oxo-2-pyrrolidin-1-ylethyl)-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propanamide;N-propyl-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propanamide
CID 161561006

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine?
The IUPAC name of 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine (CID 160797020) is 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine.
What is the SMILES notation for 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine?
The canonical SMILES for 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine is CC(=O)N1CCN(C(C)C)CC1.CC(=O)N1CCN(C(C)C)CC1C.CC(C)(C)N1CCCC(Oc2ccccc2)C1.CC(C)(C)N1CCN(Cc2cccnc2)CC1.CC(C)N1CCC(CN(C)C)CC1.CC(C)N1CCC(N(C)C)CC1.CC(C)N1CCC(c2ccccc2)C1.CC(C)N1CCCC(O)C1.CC(C)N1CCCC(c2ccccc2)C1.CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCCC[C@@H]1C.CC(C)N1CCCN(C)CC1.CC(C)N1CCN(C(=O)OC(C)(C)C)CC1.CC(C)N1CCNC(=O)C1.CC(C)N1CCNCC1.CC(C)N1CCOCC1.CC(C)N1CCc2[nH]ncc2C1.CC(C)N1C[C@@H]2C[C@H]1CN2Cc1ccccc1.CC1CN(C(C)C)CC(C)C1Cc1ccccc1.CC1CN(C(C)C)CC(C)O1.
What is the InChIKey of 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine?
The InChIKey is SCONODKHGKGMTP-FCBPHKGZSA-N. The full InChI is InChI=1S/C17H27N.C15H22N2.C15H23NO.C14H23N3.C14H21N.C13H19N.C12H24N2O2.C11H24N2.C10H20N2O.C10H22N2.C9H15N3.C9H18N2O.C9H20N2.C9H19NO.C9H19N.C8H17NO.C8H17N.C7H14N2O.C7H16N2.C7H15NO.C7H15N/c1-13(2)18-11-14(3)17(15(4)12-18)10-16-8-6-5-7-9-16;1-12(2)17-11-14-8-15(17)10-16(14)9-13-6-4-3-5-7-13;1-15(2,3)16-11-7-10-14(12-16)17-13-8-5-4-6-9-13;1-14(2,3)17-9-7-16(8-10-17)12-13-5-4-6-15-11-13;1-12(2)15-10-6-9-14(11-15)13-7-4-3-5-8-13;1-11(2)14-9-8-13(10-14)12-6-4-3-5-7-12;1-10(2)13-6-8-14(9-7-13)11(15)16-12(3,4)5;1-10(2)13-7-5-11(6-8-13)9-12(3)4;1-8(2)11-5-6-12(10(4)13)9(3)7-11;1-9(2)12-7-5-10(6-8-12)11(3)4;1-7(2)12-4-3-9-8(6-12)5-10-11-9;1-8(2)10-4-6-11(7-5-10)9(3)12;1-9(2)11-6-4-5-10(3)7-8-11;1-7(2)10-5-8(3)11-9(4)6-10;1-8(2)10-7-5-4-6-9(10)3;1-7(2)9-5-3-4-8(10)6-9;1-8(2)9-6-4-3-5-7-9;1-6(2)9-4-3-8-7(10)5-9;1-7(2)9-5-3-8-4-6-9;1-7(2)8-3-5-9-6-4-8;1-7(2)8-5-3-4-6-8/h5-9,13-15,17H,10-12H2,1-4H3;3-7,12,14-15H,8-11H2,1-2H3;4-6,8-9,14H,7,10-12H2,1-3H3;4-6,11H,7-10,12H2,1-3H3;3-5,7-8,12,14H,6,9-11H2,1-2H3;3-7,11,13H,8-10H2,1-2H3;10H,6-9H2,1-5H3;10-11H,5-9H2,1-4H3;8-9H,5-7H2,1-4H3;9-10H,5-8H2,1-4H3;5,7H,3-4,6H2,1-2H3,(H,10,11);8H,4-7H2,1-3H3;9H,4-8H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;7-8,10H,3-6H2,1-2H3;8H,3-7H2,1-2H3;6H,3-5H2,1-2H3,(H,8,10);7-8H,3-6H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3/t;14-,15-;;;;;;;;;;;;;9-;;;;;;/m.0............0....../s1.
What are the key properties of 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine?
4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine has a molecular weight of 3675.93 g/mol, XLogP of 35.28, 32 rotatable bonds, 4 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-3,5-dimethyl-1-propan-2-ylpiperidine;(1S,4S)-2-benzyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-3-phenoxypiperidine;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-tert-butyl-4-(pyridin-3-ylmethyl)piperazine;2,6-dimethyl-4-propan-2-ylmorpholine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yl-1,4-diazepane;1-(2-methyl-4-propan-2-ylpiperazin-1-yl)ethanone;(2S)-2-methyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine is sourced from PubChem (CID 160797020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).