azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine

C183H385F3N28O9 — CID 160729206

IUPACazetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine
SMILESCC(C)CN1CCC1.CC(C)CN1CCCC1.CC(C)N1CCC(N)CC1.CC(C)N1CCCCC1.CC(C)N1CCCCC1.CC(C)N1CCCN(C)CC1.CC(C)N1CCN(C(=O)OC(C)(C)C)CC1.CC(C)N1CCNC(C(C)(F)F)C1.CC(C)N1CCOCC1.CC(C)N1CC[C@H](C)C1.CC(C)N1C[C@@H](C)[C@H](O)C1.CC(C)N1C[C@@H](C)[C@H](O)C1.CC(C)N1C[C@H](C)C[C@H](C)C1.CC(C)N1C[C@H](C)[C@@H](O)C1.CC(C)N1C[C@H](C)[C@@H](O)C1.CC(F)[C@@H]1CCCN(C(C)C)C1.CC1CN(C(C)C)CC1C(=O)N1CCC1.CCC(C)C.CCCN1CCN(C(C)C)CC1.CC[C@@H]1CCCN(C(C)C)C1.CNCC(=O)N1CCN(C(C)C)CC1
InChIInChI=1S/C12H24N2O2.C12H22N2O.C10H20FN.C10H21N3O.C10H22N2.2C10H21N.C9H18F2N2.C9H20N2.C8H18N2.4C8H17NO.4C8H17N.C7H15NO.C7H15N.C5H12/c1-10(2)13-6-8-14(9-7-13)11(15)16-12(3,4)5;1-9(2)14-7-10(3)11(8-14)12(15)13-5-4-6-13;1-8(2)12-6-4-5-10(7-12)9(3)11;1-9(2)12-4-6-13(7-5-12)10(14)8-11-3;1-4-5-11-6-8-12(9-7-11)10(2)3;1-8(2)11-6-9(3)5-10(4)7-11;1-4-10-6-5-7-11(8-10)9(2)3;1-7(2)13-5-4-12-8(6-13)9(3,10)11;1-9(2)11-6-4-5-10(3)7-8-11;1-7(2)10-5-3-8(9)4-6-10;4*1-6(2)9-4-7(3)8(10)5-9;1-7(2)9-5-4-8(3)6-9;1-8(2)7-9-5-3-4-6-9;2*1-8(2)9-6-4-3-5-7-9;1-7(2)8-3-5-9-6-4-8;1-7(2)6-8-4-3-5-8;1-4-5(2)3/h10H,6-9H2,1-5H3;9-11H,4-8H2,1-3H3;8-10H,4-7H2,1-3H3;9,11H,4-8H2,1-3H3;10H,4-9H2,1-3H3;8-10H,5-7H2,1-4H3;9-10H,4-8H2,1-3H3;7-8,12H,4-6H2,1-3H3;9H,4-8H2,1-3H3;7-8H,3-6,9H2,1-2H3;4*6-8,10H,4-5H2,1-3H3;7-8H,4-6H2,1-3H3;3*8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;5H,4H2,1-3H3/t;;9?,10-;;;9-,10+;10-;;;;4*7-,8-;8-;;;;;;/m..1...1...11000....../s1
InChIKeyRUCKWHJSTLKGCV-QAIKHXIGSA-N
MW3179.27 g/mol
LogP29.04
Rot. Bonds31

About azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine

azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine (PubChem CID 160729206) has the molecular formula C183H385F3N28O9 and a molecular weight of 3179.27 g/mol. Its IUPAC name is azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine.

Molecular Properties

Compound Nameazetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine
PubChem CID160729206
Molecular FormulaC183H385F3N28O9
Molecular Weight3179.27 g/mol
Exact Mass3177.05
IUPAC Nameazetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine
SMILESCC(C)CN1CCC1.CC(C)CN1CCCC1.CC(C)N1CCC(N)CC1.CC(C)N1CCCCC1.CC(C)N1CCCCC1.CC(C)N1CCCN(C)CC1.CC(C)N1CCN(C(=O)OC(C)(C)C)CC1.CC(C)N1CCNC(C(C)(F)F)C1.CC(C)N1CCOCC1.CC(C)N1CC[C@H](C)C1.CC(C)N1C[C@@H](C)[C@H](O)C1.CC(C)N1C[C@@H](C)[C@H](O)C1.CC(C)N1C[C@H](C)C[C@H](C)C1.CC(C)N1C[C@H](C)[C@@H](O)C1.CC(C)N1C[C@H](C)[C@@H](O)C1.CC(F)[C@@H]1CCCN(C(C)C)C1.CC1CN(C(C)C)CC1C(=O)N1CCC1.CCC(C)C.CCCN1CCN(C(C)C)CC1.CC[C@@H]1CCCN(C(C)C)C1.CNCC(=O)N1CCN(C(C)C)CC1
InChIInChI=1S/C12H24N2O2.C12H22N2O.C10H20FN.C10H21N3O.C10H22N2.2C10H21N.C9H18F2N2.C9H20N2.C8H18N2.4C8H17NO.4C8H17N.C7H15NO.C7H15N.C5H12/c1-10(2)13-6-8-14(9-7-13)11(15)16-12(3,4)5;1-9(2)14-7-10(3)11(8-14)12(15)13-5-4-6-13;1-8(2)12-6-4-5-10(7-12)9(3)11;1-9(2)12-4-6-13(7-5-12)10(14)8-11-3;1-4-5-11-6-8-12(9-7-11)10(2)3;1-8(2)11-6-9(3)5-10(4)7-11;1-4-10-6-5-7-11(8-10)9(2)3;1-7(2)13-5-4-12-8(6-13)9(3,10)11;1-9(2)11-6-4-5-10(3)7-8-11;1-7(2)10-5-3-8(9)4-6-10;4*1-6(2)9-4-7(3)8(10)5-9;1-7(2)9-5-4-8(3)6-9;1-8(2)7-9-5-3-4-6-9;2*1-8(2)9-6-4-3-5-7-9;1-7(2)8-3-5-9-6-4-8;1-7(2)6-8-4-3-5-8;1-4-5(2)3/h10H,6-9H2,1-5H3;9-11H,4-8H2,1-3H3;8-10H,4-7H2,1-3H3;9,11H,4-8H2,1-3H3;10H,4-9H2,1-3H3;8-10H,5-7H2,1-4H3;9-10H,4-8H2,1-3H3;7-8,12H,4-6H2,1-3H3;9H,4-8H2,1-3H3;7-8H,3-6,9H2,1-2H3;4*6-8,10H,4-5H2,1-3H3;7-8H,4-6H2,1-3H3;3*8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;5H,4H2,1-3H3/t;;9?,10-;;;9-,10+;10-;;;;4*7-,8-;8-;;;;;;/m..1...1...11000....../s1
InChIKeyRUCKWHJSTLKGCV-QAIKHXIGSA-N
XLogP29.04
TPSA281.67 Ų
H-Bond Donors7
H-Bond Acceptors34
Rotatable Bonds31
Heavy Atoms223
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003179.27
LogP ≤ 529.04
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1034

Analyze azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine?
The IUPAC name of azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine (CID 160729206) is azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine.
What is the SMILES notation for azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine?
The canonical SMILES for azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine is CC(C)CN1CCC1.CC(C)CN1CCCC1.CC(C)N1CCC(N)CC1.CC(C)N1CCCCC1.CC(C)N1CCCCC1.CC(C)N1CCCN(C)CC1.CC(C)N1CCN(C(=O)OC(C)(C)C)CC1.CC(C)N1CCNC(C(C)(F)F)C1.CC(C)N1CCOCC1.CC(C)N1CC[C@H](C)C1.CC(C)N1C[C@@H](C)[C@H](O)C1.CC(C)N1C[C@@H](C)[C@H](O)C1.CC(C)N1C[C@H](C)C[C@H](C)C1.CC(C)N1C[C@H](C)[C@@H](O)C1.CC(C)N1C[C@H](C)[C@@H](O)C1.CC(F)[C@@H]1CCCN(C(C)C)C1.CC1CN(C(C)C)CC1C(=O)N1CCC1.CCC(C)C.CCCN1CCN(C(C)C)CC1.CC[C@@H]1CCCN(C(C)C)C1.CNCC(=O)N1CCN(C(C)C)CC1.
What is the InChIKey of azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine?
The InChIKey is RUCKWHJSTLKGCV-QAIKHXIGSA-N. The full InChI is InChI=1S/C12H24N2O2.C12H22N2O.C10H20FN.C10H21N3O.C10H22N2.2C10H21N.C9H18F2N2.C9H20N2.C8H18N2.4C8H17NO.4C8H17N.C7H15NO.C7H15N.C5H12/c1-10(2)13-6-8-14(9-7-13)11(15)16-12(3,4)5;1-9(2)14-7-10(3)11(8-14)12(15)13-5-4-6-13;1-8(2)12-6-4-5-10(7-12)9(3)11;1-9(2)12-4-6-13(7-5-12)10(14)8-11-3;1-4-5-11-6-8-12(9-7-11)10(2)3;1-8(2)11-6-9(3)5-10(4)7-11;1-4-10-6-5-7-11(8-10)9(2)3;1-7(2)13-5-4-12-8(6-13)9(3,10)11;1-9(2)11-6-4-5-10(3)7-8-11;1-7(2)10-5-3-8(9)4-6-10;4*1-6(2)9-4-7(3)8(10)5-9;1-7(2)9-5-4-8(3)6-9;1-8(2)7-9-5-3-4-6-9;2*1-8(2)9-6-4-3-5-7-9;1-7(2)8-3-5-9-6-4-8;1-7(2)6-8-4-3-5-8;1-4-5(2)3/h10H,6-9H2,1-5H3;9-11H,4-8H2,1-3H3;8-10H,4-7H2,1-3H3;9,11H,4-8H2,1-3H3;10H,4-9H2,1-3H3;8-10H,5-7H2,1-4H3;9-10H,4-8H2,1-3H3;7-8,12H,4-6H2,1-3H3;9H,4-8H2,1-3H3;7-8H,3-6,9H2,1-2H3;4*6-8,10H,4-5H2,1-3H3;7-8H,4-6H2,1-3H3;3*8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;5H,4H2,1-3H3/t;;9?,10-;;;9-,10+;10-;;;;4*7-,8-;8-;;;;;;/m..1...1...11000....../s1.
What are the key properties of azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine?
azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine has a molecular weight of 3179.27 g/mol, XLogP of 29.04, 31 rotatable bonds, 7 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-1-yl-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)methanone;tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;3-(1,1-difluoroethyl)-1-propan-2-ylpiperazine;(3S,5R)-3,5-dimethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;2-(methylamino)-1-(4-propan-2-ylpiperazin-1-yl)ethanone;2-methylbutane;1-methyl-4-propan-2-yl-1,4-diazepane;(3S)-3-methyl-1-propan-2-ylpyrrolidine;bis((3R,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);bis((3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-ol);1-(2-methylpropyl)azetidine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidin-4-amine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperazine is sourced from PubChem (CID 160729206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).