cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine

C225H393N19O24S8 — CID 160888818

IUPACcumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine
SMILESCC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CCN(CC)CCOC.CCN(CC)CCS(C)(=O)=O.CN(C)CCN(C)S(C)(=O)=O.CN(C)CCS(C)(=O)=O.CN1CCN(CCS(C)(=O)=O)CC1.COCCN1CCCC1.COCCN1CCCCC1.COCCN1CCN(C)CC1.COCCN1CCNCC1.COCCN1CCOCC1.CS(=O)(=O)CCN1CCCC1.CS(=O)(=O)CCN1CCCCC1.CS(=O)(=O)CCN1CCNCC1.CS(=O)(=O)CCN1CCOCC1
InChIInChI=1S/14C9H12.C8H18N2O2S.C8H18N2O.C8H17NO2S.C8H17NO.C7H16N2O2S.C7H16N2O.C7H15NO3S.C7H15NO2S.C7H17NO2S.C7H15NO2.C7H15NO.C7H17NO.C6H16N2O2S.C5H13NO2S/c14*1-8(2)9-6-4-3-5-7-9;1-9-3-5-10(6-4-9)7-8-13(2,11)12;1-9-3-5-10(6-4-9)7-8-11-2;1-12(10,11)8-7-9-5-3-2-4-6-9;1-10-8-7-9-5-3-2-4-6-9;1-12(10,11)7-6-9-4-2-8-3-5-9;1-10-7-6-9-4-2-8-3-5-9;1-12(9,10)7-4-8-2-5-11-6-3-8;1-11(9,10)7-6-8-4-2-3-5-8;1-4-8(5-2)6-7-11(3,9)10;1-9-5-2-8-3-6-10-7-4-8;1-9-7-6-8-4-2-3-5-8;1-4-8(5-2)6-7-9-3;1-7(2)5-6-8(3)11(4,9)10;1-6(2)4-5-9(3,7)8/h14*3-8H,1-2H3;3-8H2,1-2H3;3-8H2,1-2H3;2-8H2,1H3;2-8H2,1H3;8H,2-7H2,1H3;8H,2-7H2,1H3;2-7H2,1H3;2-7H2,1H3;4-7H2,1-3H3;2-7H2,1H3;2-7H2,1H3;4-7H2,1-3H3;5-6H2,1-4H3;4-5H2,1-3H3
InChIKeySNZJLKUOEJCTCK-UHFFFAOYSA-N
MW4005.26 g/mol
LogP39.17
Rot. Bonds61

About cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine

cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine (PubChem CID 160888818) has the molecular formula C225H393N19O24S8 and a molecular weight of 4005.26 g/mol. Its IUPAC name is cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine.

Molecular Properties

Compound Namecumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine
PubChem CID160888818
Molecular FormulaC225H393N19O24S8
Molecular Weight4005.26 g/mol
Exact Mass4001.79
IUPAC Namecumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine
SMILESCC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CCN(CC)CCOC.CCN(CC)CCS(C)(=O)=O.CN(C)CCN(C)S(C)(=O)=O.CN(C)CCS(C)(=O)=O.CN1CCN(CCS(C)(=O)=O)CC1.COCCN1CCCC1.COCCN1CCCCC1.COCCN1CCN(C)CC1.COCCN1CCNCC1.COCCN1CCOCC1.CS(=O)(=O)CCN1CCCC1.CS(=O)(=O)CCN1CCCCC1.CS(=O)(=O)CCN1CCNCC1.CS(=O)(=O)CCN1CCOCC1
InChIInChI=1S/14C9H12.C8H18N2O2S.C8H18N2O.C8H17NO2S.C8H17NO.C7H16N2O2S.C7H16N2O.C7H15NO3S.C7H15NO2S.C7H17NO2S.C7H15NO2.C7H15NO.C7H17NO.C6H16N2O2S.C5H13NO2S/c14*1-8(2)9-6-4-3-5-7-9;1-9-3-5-10(6-4-9)7-8-13(2,11)12;1-9-3-5-10(6-4-9)7-8-11-2;1-12(10,11)8-7-9-5-3-2-4-6-9;1-10-8-7-9-5-3-2-4-6-9;1-12(10,11)7-6-9-4-2-8-3-5-9;1-10-7-6-9-4-2-8-3-5-9;1-12(9,10)7-4-8-2-5-11-6-3-8;1-11(9,10)7-6-8-4-2-3-5-8;1-4-8(5-2)6-7-11(3,9)10;1-9-5-2-8-3-6-10-7-4-8;1-9-7-6-8-4-2-3-5-8;1-4-8(5-2)6-7-9-3;1-7(2)5-6-8(3)11(4,9)10;1-6(2)4-5-9(3,7)8/h14*3-8H,1-2H3;3-8H2,1-2H3;3-8H2,1-2H3;2-8H2,1H3;2-8H2,1H3;8H,2-7H2,1H3;8H,2-7H2,1H3;2-7H2,1H3;2-7H2,1H3;4-7H2,1-3H3;2-7H2,1H3;2-7H2,1H3;4-7H2,1-3H3;5-6H2,1-4H3;4-5H2,1-3H3
InChIKeySNZJLKUOEJCTCK-UHFFFAOYSA-N
XLogP39.17
TPSA426.10 Ų
H-Bond Donors2
H-Bond Acceptors42
Rotatable Bonds61
Heavy Atoms276
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004005.26
LogP ≤ 539.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1042

Analyze cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine 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

N-[2-(diethylamino)ethyl]-N-methylacetamide;N-[2-(dimethylamino)ethyl]-N-methylacetamide;bis(N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide);bis(N-methyl-N-(2-morpholin-4-ylethyl)acetamide);bis(N-methyl-N-(2-piperazin-1-ylethyl)acetamide);N-methyl-N-(2-pyrrolidin-1-ylethyl)acetamide;hexakis(3-propan-2-ylpyridine);tris(4-propan-2-ylpyridine)
CID 162237404
N,N-diethyl-4-propan-2-ylbenzenesulfonamide;N,N-diethyl-2-(4-propan-2-ylphenoxy)ethanamine;N,N-dimethyl-2-(4-propan-2-ylphenoxy)ethanamine;ethane;1-methyl-4-(4-propan-2-ylphenyl)sulfonylpiperazine;4-[2-(4-propan-2-ylphenoxy)ethyl]morpholine;bis(1-[2-(4-propan-2-ylphenoxy)ethyl]piperazine);1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;1-[2-(4-propan-2-ylphenoxy)ethyl]pyrrolidine;1-(4-propan-2-ylphenyl)sulfonylpiperazine;4-(4-propan-2-ylphenyl)sulfonylpiperidine
CID 158106979
N-[2-(diethylamino)ethyl]-N-methylacetamide;N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide;N-methyl-N-(2-morpholin-4-ylethyl)acetamide;N-methyl-N-(2-piperazin-1-ylethyl)acetamide;N-methyl-N-(2-pyrrolidin-1-ylethyl)acetamide;pentakis(3-propan-2-ylpyridine)
CID 159120227
1,2-dimethoxyethane;2-(dimethylamino)ethanol;3-(dimethylamino)propane-1,2-diol;N,N-dimethylmethanamine;N,N-dimethyl-2-morpholin-4-ylethanamine;1,4-dimethylpiperazine;N,N-dimethyl-2-piperidin-1-ylethanamine;N,N-dimethyl-2-pyrrolidin-1-ylethanamine;2-(1,1-dioxo-1,4-thiazinan-4-yl)-N,N-dimethylethanamine;2-[2-hydroxyethyl(methyl)amino]ethanol;bis(2-methoxy-N,N-dimethylethanamine);1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;2-methoxy-N-(2-methoxyethyl)-N-methylethanamine;1-methoxy-2-methylsulfonylethane;2-(methylamino)ethanol;N-methylmethanamine;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine;1-methylpyrrolidine;4-methylthiomorpholine;N,N,N',N'-tetramethylethane-1,2-diamine
CID 158412879
N-(2-methoxyethyl)-N-methyl-2-piperazin-1-ylethanesulfonamide
CID 54972243
1,2-dimethoxyethane;N,N-dimethylmethanamine;N,N-dimethyl-2-morpholin-4-ylethanamine;1,4-dimethylpiperazine;N,N-dimethyl-2-piperidin-1-ylethanamine;N,N-dimethyl-2-pyrrolidin-1-ylethanamine;2-(1,1-dioxo-1,4-thiazinan-4-yl)-N,N-dimethylethanamine;bis(2-methoxy-N,N-dimethylethanamine);4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;4-(2-methoxyethyl)-1,4-thiazinane 1,1-dioxide;2-methoxy-N-(2-methoxyethyl)-N-methylethanamine;1-methoxy-2-methylsulfonylethane;4-methylmorpholine;1-methylpiperidine;1-methylpyrrolidine;N,N',N'-trimethylpropane-1,3-diamine
CID 161131756
ethane;N-methyl-N-(2-morpholin-4-ylethyl)-3-propan-2-ylaniline;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(3-propan-2-ylphenoxy)ethyl]piperidine
CID 167535418
N,N-diethyl-2-methoxyethanamine;N-[2-(dimethylamino)ethyl]-N-ethylacetamide;4-(2-methoxyethyl)morpholine;4-[2-(4-methylphenoxy)ethyl]morpholine;1-[2-(4-methylphenoxy)ethyl]pyrrolidine;(4-methylphenyl)-(4-methylpiperidin-1-yl)methanone
CID 158725021
1-butyl-4-[2-(2-methoxyethoxy)ethyl]piperazine;tert-butyl 4-[2-(2-methoxyethoxy)ethyl]piperazine-1-carboxylate;1-[2-(2-methoxyethoxy)ethyl]-4-methylpiperazine;4-[2-(2-methoxyethoxy)ethyl]morpholine;1-[2-(2-methoxyethoxy)ethyl]piperazine;1-[2-(2-methoxyethoxy)ethyl]pyrrolidine
CID 167590242
ethane;4-[2-[4-(2-methoxyethyl)piperazin-1-yl]ethyl]morpholine
CID 143677740
1-(2-methoxyethyl)-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine
CID 161159887
N-benzyl-3-(diethylaminomethyl)-N-methylbenzenesulfonamide;N-benzyl-N-methyl-3-[(2-morpholin-4-ylethylamino)methyl]benzenesulfonamide;N-benzyl-N-methyl-3-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N,N-bis(2-methoxyethyl)-3-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-3-[(4-methylpiperazin-1-yl)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-3-[(4-propan-2-ylpiperazin-1-yl)methyl]benzenesulfonamide
CID 159648316

Frequently Asked Questions

What is the IUPAC name of cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine?
The IUPAC name of cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine (CID 160888818) is cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine.
What is the SMILES notation for cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine?
The canonical SMILES for cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine is CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccc1.CCN(CC)CCOC.CCN(CC)CCS(C)(=O)=O.CN(C)CCN(C)S(C)(=O)=O.CN(C)CCS(C)(=O)=O.CN1CCN(CCS(C)(=O)=O)CC1.COCCN1CCCC1.COCCN1CCCCC1.COCCN1CCN(C)CC1.COCCN1CCNCC1.COCCN1CCOCC1.CS(=O)(=O)CCN1CCCC1.CS(=O)(=O)CCN1CCCCC1.CS(=O)(=O)CCN1CCNCC1.CS(=O)(=O)CCN1CCOCC1.
What is the InChIKey of cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine?
The InChIKey is SNZJLKUOEJCTCK-UHFFFAOYSA-N. The full InChI is InChI=1S/14C9H12.C8H18N2O2S.C8H18N2O.C8H17NO2S.C8H17NO.C7H16N2O2S.C7H16N2O.C7H15NO3S.C7H15NO2S.C7H17NO2S.C7H15NO2.C7H15NO.C7H17NO.C6H16N2O2S.C5H13NO2S/c14*1-8(2)9-6-4-3-5-7-9;1-9-3-5-10(6-4-9)7-8-13(2,11)12;1-9-3-5-10(6-4-9)7-8-11-2;1-12(10,11)8-7-9-5-3-2-4-6-9;1-10-8-7-9-5-3-2-4-6-9;1-12(10,11)7-6-9-4-2-8-3-5-9;1-10-7-6-9-4-2-8-3-5-9;1-12(9,10)7-4-8-2-5-11-6-3-8;1-11(9,10)7-6-8-4-2-3-5-8;1-4-8(5-2)6-7-11(3,9)10;1-9-5-2-8-3-6-10-7-4-8;1-9-7-6-8-4-2-3-5-8;1-4-8(5-2)6-7-9-3;1-7(2)5-6-8(3)11(4,9)10;1-6(2)4-5-9(3,7)8/h14*3-8H,1-2H3;3-8H2,1-2H3;3-8H2,1-2H3;2-8H2,1H3;2-8H2,1H3;8H,2-7H2,1H3;8H,2-7H2,1H3;2-7H2,1H3;2-7H2,1H3;4-7H2,1-3H3;2-7H2,1H3;2-7H2,1H3;4-7H2,1-3H3;5-6H2,1-4H3;4-5H2,1-3H3.
What are the key properties of cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine?
cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine has a molecular weight of 4005.26 g/mol, XLogP of 39.17, 61 rotatable bonds, 2 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for cumene;N,N-diethyl-2-methoxyethanamine;N,N-diethyl-2-methylsulfonylethanamine;N-[2-(dimethylamino)ethyl]-N-methylmethanesulfonamide;N,N-dimethyl-2-methylsulfonylethanamine;1-(2-methoxyethyl)-4-methylpiperazine;4-(2-methoxyethyl)morpholine;1-(2-methoxyethyl)piperazine;1-(2-methoxyethyl)piperidine;1-(2-methoxyethyl)pyrrolidine;1-methyl-4-(2-methylsulfonylethyl)piperazine;4-(2-methylsulfonylethyl)morpholine;1-(2-methylsulfonylethyl)piperazine;1-(2-methylsulfonylethyl)piperidine;1-(2-methylsulfonylethyl)pyrrolidine is sourced from PubChem (CID 160888818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).