5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone

C191H269ClN20O24 — CID 160514690

IUPAC5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone
SMILESC=CCC1CCN(C)C1C(C)=O.CC(=O)C1C(C(C)C)CCN1C.CC(=O)C1C(C)CCN1C.CC(=O)C1C(C2CCCCC2)CCN1C.CC(=O)C1CC(C#N)CN1C.CC(=O)C1CC(OC(=O)N2CCc3ccccc3C2)CN1C.CC(=O)C1CC(OC(=O)c2ccc3ccccc3c2)CN1C.CC(=O)C1CC(Oc2ccc(Cl)cn2)CN1C.CC(=O)C1CC(Oc2ccc3ccccc3c2)CN1C.CC(=O)C1CC(Oc2cccc3ccccc23)CN1C.CC(=O)C1CC(Oc2ccccc2)CN1C.CC(=O)C1CC(Oc2ncnc3ccccc23)CN1C.CC(=O)C1CC(c2ccccc2)CN1C.CCC(C)C1CCN(C)C1C(C)=O.CCC1CCN(C)C1C(C)=O
InChIInChI=1S/C18H19NO3.C17H22N2O3.2C17H19NO2.C15H17N3O2.C13H17NO2.C13H17NO.C13H23NO.C12H15ClN2O2.C11H21NO.C10H19NO.C10H17NO.C9H17NO.C8H12N2O.C8H15NO/c1-12(20)17-10-16(11-19(17)2)22-18(21)15-8-7-13-5-3-4-6-14(13)9-15;1-12(20)16-9-15(11-18(16)2)22-17(21)19-8-7-13-5-3-4-6-14(13)10-19;1-12(19)16-10-14(11-18(16)2)20-17-9-5-7-13-6-3-4-8-15(13)17;1-12(19)17-10-16(11-18(17)2)20-15-8-7-13-5-3-4-6-14(13)9-15;1-10(19)14-7-11(8-18(14)2)20-15-12-5-3-4-6-13(12)16-9-17-15;1-10(15)13-8-12(9-14(13)2)16-11-6-4-3-5-7-11;1-10(15)13-8-12(9-14(13)2)11-6-4-3-5-7-11;1-10(15)13-12(8-9-14(13)2)11-6-4-3-5-7-11;1-8(16)11-5-10(7-15(11)2)17-12-4-3-9(13)6-14-12;1-5-8(2)10-6-7-12(4)11(10)9(3)13;1-7(2)9-5-6-11(4)10(9)8(3)12;1-4-5-9-6-7-11(3)10(9)8(2)12;1-4-8-5-6-10(3)9(8)7(2)11;1-6(11)8-3-7(4-9)5-10(8)2;1-6-4-5-9(3)8(6)7(2)10/h3-9,16-17H,10-11H2,1-2H3;3-6,15-16H,7-11H2,1-2H3;3-9,14,16H,10-11H2,1-2H3;3-9,16-17H,10-11H2,1-2H3;3-6,9,11,14H,7-8H2,1-2H3;3-7,12-13H,8-9H2,1-2H3;3-7,12-13H,8-9H2,1-2H3;11-13H,3-9H2,1-2H3;3-4,6,10-11H,5,7H2,1-2H3;8,10-11H,5-7H2,1-4H3;7,9-10H,5-6H2,1-4H3;4,9-10H,1,5-7H2,2-3H3;8-9H,4-6H2,1-3H3;7-8H,3,5H2,1-2H3;6,8H,4-5H2,1-3H3
InChIKeyQTMNHGACZGQFHT-UHFFFAOYSA-N
MW3264.82 g/mol
LogP27.58
Rot. Bonds36

About 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone

5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone (PubChem CID 160514690) has the molecular formula C191H269ClN20O24 and a molecular weight of 3264.82 g/mol. Its IUPAC name is 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone.

Molecular Properties

Compound Name5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone
PubChem CID160514690
Molecular FormulaC191H269ClN20O24
Molecular Weight3264.82 g/mol
Exact Mass3262.01
IUPAC Name5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone
SMILESC=CCC1CCN(C)C1C(C)=O.CC(=O)C1C(C(C)C)CCN1C.CC(=O)C1C(C)CCN1C.CC(=O)C1C(C2CCCCC2)CCN1C.CC(=O)C1CC(C#N)CN1C.CC(=O)C1CC(OC(=O)N2CCc3ccccc3C2)CN1C.CC(=O)C1CC(OC(=O)c2ccc3ccccc3c2)CN1C.CC(=O)C1CC(Oc2ccc(Cl)cn2)CN1C.CC(=O)C1CC(Oc2ccc3ccccc3c2)CN1C.CC(=O)C1CC(Oc2cccc3ccccc23)CN1C.CC(=O)C1CC(Oc2ccccc2)CN1C.CC(=O)C1CC(Oc2ncnc3ccccc23)CN1C.CC(=O)C1CC(c2ccccc2)CN1C.CCC(C)C1CCN(C)C1C(C)=O.CCC1CCN(C)C1C(C)=O
InChIInChI=1S/C18H19NO3.C17H22N2O3.2C17H19NO2.C15H17N3O2.C13H17NO2.C13H17NO.C13H23NO.C12H15ClN2O2.C11H21NO.C10H19NO.C10H17NO.C9H17NO.C8H12N2O.C8H15NO/c1-12(20)17-10-16(11-19(17)2)22-18(21)15-8-7-13-5-3-4-6-14(13)9-15;1-12(20)16-9-15(11-18(16)2)22-17(21)19-8-7-13-5-3-4-6-14(13)10-19;1-12(19)16-10-14(11-18(16)2)20-17-9-5-7-13-6-3-4-8-15(13)17;1-12(19)17-10-16(11-18(17)2)20-15-8-7-13-5-3-4-6-14(13)9-15;1-10(19)14-7-11(8-18(14)2)20-15-12-5-3-4-6-13(12)16-9-17-15;1-10(15)13-8-12(9-14(13)2)16-11-6-4-3-5-7-11;1-10(15)13-8-12(9-14(13)2)11-6-4-3-5-7-11;1-10(15)13-12(8-9-14(13)2)11-6-4-3-5-7-11;1-8(16)11-5-10(7-15(11)2)17-12-4-3-9(13)6-14-12;1-5-8(2)10-6-7-12(4)11(10)9(3)13;1-7(2)9-5-6-11(4)10(9)8(3)12;1-4-5-9-6-7-11(3)10(9)8(2)12;1-4-8-5-6-10(3)9(8)7(2)11;1-6(11)8-3-7(4-9)5-10(8)2;1-6-4-5-9(3)8(6)7(2)10/h3-9,16-17H,10-11H2,1-2H3;3-6,15-16H,7-11H2,1-2H3;3-9,14,16H,10-11H2,1-2H3;3-9,16-17H,10-11H2,1-2H3;3-6,9,11,14H,7-8H2,1-2H3;3-7,12-13H,8-9H2,1-2H3;3-7,12-13H,8-9H2,1-2H3;11-13H,3-9H2,1-2H3;3-4,6,10-11H,5,7H2,1-2H3;8,10-11H,5-7H2,1-4H3;7,9-10H,5-6H2,1-4H3;4,9-10H,1,5-7H2,2-3H3;8-9H,4-6H2,1-3H3;7-8H,3,5H2,1-2H3;6,8H,4-5H2,1-3H3
InChIKeyQTMNHGACZGQFHT-UHFFFAOYSA-N
XLogP27.58
TPSA469.10 Ų
H-Bond Donors
H-Bond Acceptors43
Rotatable Bonds36
Heavy Atoms236
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003264.82
LogP ≤ 527.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1043

Computed Properties (RDKit)

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

Analyze 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-Tert-butyl-4-[(5-chloro-2-pyridinyl)oxy]pyrrolidin-2-yl]-2,2-dimethylpropan-1-one;1-(1-tert-butyl-5-methylpyrrolidin-2-yl)-2,2-dimethylpropan-1-one;1-(1-tert-butyl-4-naphthalen-1-yloxypyrrolidin-2-yl)-2,2-dimethylpropan-1-one;1-(1-tert-butyl-4-naphthalen-2-yloxypyrrolidin-2-yl)-2,2-dimethylpropan-1-one;1-(1-tert-butyl-4-phenoxypyrrolidin-2-yl)-2,2-dimethylpropan-1-one;1-(1-tert-butyl-5-phenylpyrrolidin-2-yl)-2,2-dimethylpropan-1-one;1-(1-tert-butyl-4-quinazolin-4-yloxypyrrolidin-2-yl)-2,2-dimethylpropan-1-one
CID 158604428
5-chloro-2-(1,5-ditert-butylpyrrolidin-3-yl)oxypyridine;1,2-ditert-butyl-4-naphthalen-1-yloxypyrrolidine;1,2-ditert-butyl-4-naphthalen-2-yloxypyrrolidine;1,2-ditert-butyl-4-phenoxypyrrolidine;(1,5-ditert-butylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(1,5-ditert-butylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinazoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline
CID 158620510
1-[4-[(5-Chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(5-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,5-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1,4-dimethylpyrrolidin-2-yl)ethanone;1-(4-ethyl-1,3-dimethylpyrrolidin-2-yl)ethanone;1-(1-methyl-5-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone;1-(1,3,4-trimethylpyrrolidin-2-yl)ethanone
CID 158813004
1-[4-[(5-Chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(5-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-[4-(5,8-dihydroquinazolin-4-yloxy)-1-methylpyrrolidin-2-yl]ethanone;1-(1,5-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1,4-dimethylpyrrolidin-2-yl)ethanone;1-(4-ethyl-1,3-dimethylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-5-phenylpyrrolidin-2-yl)ethanone;1-(1,3,4-trimethylpyrrolidin-2-yl)ethanone
CID 158828907
1,2-ditert-butyl-4-naphthalen-1-yloxypyrrolidine;1,2-ditert-butyl-4-naphthalen-2-yloxypyrrolidine;1,2-ditert-butyl-4-phenoxypyrrolidine;(1,5-ditert-butylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(1,5-ditert-butylpyrrolidin-3-yl) naphthalene-2-carboxylate;4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinazoline
CID 158979996
5-chloro-2-(1,5-ditert-butylpyrrolidin-3-yl)oxypyridine;1,2-ditert-butyl-4-naphthalen-1-yloxypyrrolidine;1,2-ditert-butyl-4-naphthalen-2-yloxypyrrolidine;1,2-ditert-butyl-4-phenoxypyrrolidine;(1,5-ditert-butylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(1,5-ditert-butylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinazoline
CID 159149673
1-[4-[(5-Chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(5-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,5-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1,4-dimethylpyrrolidin-2-yl)ethanone;1-(4-ethyl-1,3-dimethylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-5-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone;1-(1,3,4-trimethylpyrrolidin-2-yl)ethanone
CID 159818045
[1-tert-butyl-5-(2,2-dimethylpropanoyl)pyrrolidin-3-yl] 3,4-dihydro-1H-isoquinoline-2-carboxylate;[1-tert-butyl-5-(2,2-dimethylpropanoyl)pyrrolidin-3-yl] naphthalene-2-carboxylate;1-(1-tert-butyl-4-naphthalen-1-yloxypyrrolidin-2-yl)-2,2-dimethylpropan-1-one;1-(1-tert-butyl-4-naphthalen-2-yloxypyrrolidin-2-yl)-2,2-dimethylpropan-1-one;1-(1-tert-butyl-4-phenoxypyrrolidin-2-yl)-2,2-dimethylpropan-1-one;1-(1-tert-butyl-4-quinazolin-4-yloxypyrrolidin-2-yl)-2,2-dimethylpropan-1-one
CID 160029905
5-chloro-2-(1,5-ditert-butylpyrrolidin-3-yl)oxypyridine;1,2-ditert-butyl-4-naphthalen-1-yloxypyrrolidine;1,2-ditert-butyl-4-naphthalen-2-yloxypyrrolidine;1,2-ditert-butyl-4-phenoxypyrrolidine;(1,5-ditert-butylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(1,5-ditert-butylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinazoline
CID 160159573
(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(1,5-dimethylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-5-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone
CID 160260886
1-[4-[(5-Chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(5-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,5-dimethylpyrrolidin-2-yl)ethanone;1-(4-ethyl-1,3-dimethylpyrrolidin-2-yl)ethanone;1-(1-methyl-5-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone;1-(1,3,4-trimethylpyrrolidin-2-yl)ethanone
CID 160589630
1-[4-[(5-Chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(5-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,5-dimethylpyrrolidin-2-yl)ethanone;1-(4-ethyl-1,3-dimethylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-5-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone;1-(1,3,4-trimethylpyrrolidin-2-yl)ethanone
CID 160712586

Frequently Asked Questions

What is the IUPAC name of 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone?
The IUPAC name of 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone (CID 160514690) is 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone.
What is the SMILES notation for 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone?
The canonical SMILES for 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone is C=CCC1CCN(C)C1C(C)=O.CC(=O)C1C(C(C)C)CCN1C.CC(=O)C1C(C)CCN1C.CC(=O)C1C(C2CCCCC2)CCN1C.CC(=O)C1CC(C#N)CN1C.CC(=O)C1CC(OC(=O)N2CCc3ccccc3C2)CN1C.CC(=O)C1CC(OC(=O)c2ccc3ccccc3c2)CN1C.CC(=O)C1CC(Oc2ccc(Cl)cn2)CN1C.CC(=O)C1CC(Oc2ccc3ccccc3c2)CN1C.CC(=O)C1CC(Oc2cccc3ccccc23)CN1C.CC(=O)C1CC(Oc2ccccc2)CN1C.CC(=O)C1CC(Oc2ncnc3ccccc23)CN1C.CC(=O)C1CC(c2ccccc2)CN1C.CCC(C)C1CCN(C)C1C(C)=O.CCC1CCN(C)C1C(C)=O.
What is the InChIKey of 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone?
The InChIKey is QTMNHGACZGQFHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3.C17H22N2O3.2C17H19NO2.C15H17N3O2.C13H17NO2.C13H17NO.C13H23NO.C12H15ClN2O2.C11H21NO.C10H19NO.C10H17NO.C9H17NO.C8H12N2O.C8H15NO/c1-12(20)17-10-16(11-19(17)2)22-18(21)15-8-7-13-5-3-4-6-14(13)9-15;1-12(20)16-9-15(11-18(16)2)22-17(21)19-8-7-13-5-3-4-6-14(13)10-19;1-12(19)16-10-14(11-18(16)2)20-17-9-5-7-13-6-3-4-8-15(13)17;1-12(19)17-10-16(11-18(17)2)20-15-8-7-13-5-3-4-6-14(13)9-15;1-10(19)14-7-11(8-18(14)2)20-15-12-5-3-4-6-13(12)16-9-17-15;1-10(15)13-8-12(9-14(13)2)16-11-6-4-3-5-7-11;1-10(15)13-8-12(9-14(13)2)11-6-4-3-5-7-11;1-10(15)13-12(8-9-14(13)2)11-6-4-3-5-7-11;1-8(16)11-5-10(7-15(11)2)17-12-4-3-9(13)6-14-12;1-5-8(2)10-6-7-12(4)11(10)9(3)13;1-7(2)9-5-6-11(4)10(9)8(3)12;1-4-5-9-6-7-11(3)10(9)8(2)12;1-4-8-5-6-10(3)9(8)7(2)11;1-6(11)8-3-7(4-9)5-10(8)2;1-6-4-5-9(3)8(6)7(2)10/h3-9,16-17H,10-11H2,1-2H3;3-6,15-16H,7-11H2,1-2H3;3-9,14,16H,10-11H2,1-2H3;3-9,16-17H,10-11H2,1-2H3;3-6,9,11,14H,7-8H2,1-2H3;3-7,12-13H,8-9H2,1-2H3;3-7,12-13H,8-9H2,1-2H3;11-13H,3-9H2,1-2H3;3-4,6,10-11H,5,7H2,1-2H3;8,10-11H,5-7H2,1-4H3;7,9-10H,5-6H2,1-4H3;4,9-10H,1,5-7H2,2-3H3;8-9H,4-6H2,1-3H3;7-8H,3,5H2,1-2H3;6,8H,4-5H2,1-3H3.
What are the key properties of 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone?
5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone has a molecular weight of 3264.82 g/mol, XLogP of 27.58, 36 rotatable bonds, 0 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetyl-1-methylpyrrolidine-3-carbonitrile;(5-acetyl-1-methylpyrrolidin-3-yl) 3,4-dihydro-1H-isoquinoline-2-carboxylate;(5-acetyl-1-methylpyrrolidin-3-yl) naphthalene-2-carboxylate;1-(3-butan-2-yl-1-methylpyrrolidin-2-yl)ethanone;1-[4-[(5-chloro-2-pyridinyl)oxy]-1-methylpyrrolidin-2-yl]ethanone;1-(3-cyclohexyl-1-methylpyrrolidin-2-yl)ethanone;1-(1,3-dimethylpyrrolidin-2-yl)ethanone;1-(3-ethyl-1-methylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-1-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-naphthalen-2-yloxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenoxypyrrolidin-2-yl)ethanone;1-(1-methyl-4-phenylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-propan-2-ylpyrrolidin-2-yl)ethanone;1-(1-methyl-3-prop-2-enylpyrrolidin-2-yl)ethanone;1-(1-methyl-4-quinazolin-4-yloxypyrrolidin-2-yl)ethanone is sourced from PubChem (CID 160514690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).