cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline

C275H399N5O4S2 — CID 159015091

IUPACcumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline
SMILESC.C.C.C.C=C(C)Nc1ccc(C(C)C)cc1.CC(=O)c1ccc(C(C)C)cc1.CC(C)C1CC1c1ccccc1.CC(C)C1CCCCC1.CC(C)C1Cc2ccccc2C1.CC(C)CCc1ccccc1.CC(C)CCc1ccccc1.CC(C)CCc1cccs1.CC(C)CCc1ccncc1.CC(C)N1CCCCC1.CC(C)c1ccc(-c2cscn2)cc1.CC(C)c1ccc(C2CCCCC2)cc1.CC(C)c1ccc(N2CCCCC2)cc1.CC(C)c1ccc(Oc2ccccc2)cc1.CC(C)c1ccc2c(c1)OCO2.CC(C)c1ccccc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1C.Cc1cccc(C(C)C)c1.Cc1ccccc1C(C)C
InChIInChI=1S/C15H16O.C15H22.C14H21N.C12H13NS.C12H17N.2C12H16.C11H14O.3C11H16.C10H15N.C10H12O2.8C10H14.C9H14S.C9H18.C9H12.C8H17N.4CH4/c1-12(2)13-8-10-15(11-9-13)16-14-6-4-3-5-7-14;1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14;1-12(2)13-6-8-14(9-7-13)15-10-4-3-5-11-15;1-9(2)10-3-5-11(6-4-10)12-7-14-8-13-12;1-9(2)11-5-7-12(8-6-11)13-10(3)4;1-9(2)12-7-10-5-3-4-6-11(10)8-12;1-9(2)11-8-12(11)10-6-4-3-5-7-10;1-8(2)10-4-6-11(7-5-10)9(3)12;1-8(2)11-6-5-9(3)10(4)7-11;2*1-10(2)8-9-11-6-4-3-5-7-11;1-9(2)3-4-10-5-7-11-8-6-10;1-7(2)8-3-4-9-10(5-8)12-6-11-9;6*1-8(2)10-6-4-9(3)5-7-10;1-8(2)10-6-4-5-9(3)7-10;1-8(2)10-7-5-4-6-9(10)3;1-8(2)5-6-9-4-3-7-10-9;3*1-8(2)9-6-4-3-5-7-9;;;;/h3-12H,1-2H3;8-12,14H,3-7H2,1-2H3;6-9,12H,3-5,10-11H2,1-2H3;3-9H,1-2H3;5-9,13H,3H2,1-2,4H3;3-6,9,12H,7-8H2,1-2H3;3-7,9,11-12H,8H2,1-2H3;4-8H,1-3H3;5-8H,1-4H3;2*3-7,10H,8-9H2,1-2H3;5-9H,3-4H2,1-2H3;3-5,7H,6H2,1-2H3;8*4-8H,1-3H3;3-4,7-8H,5-6H2,1-2H3;8-9H,3-7H2,1-2H3;3-8H,1-2H3;8H,3-7H2,1-2H3;4*1H4
InChIKeyJSZHQMULTLOQCK-UHFFFAOYSA-N
MW3903.38 g/mol
LogP84.39
Rot. Bonds42

About cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline

cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline (PubChem CID 159015091) has the molecular formula C275H399N5O4S2 and a molecular weight of 3903.38 g/mol. Its IUPAC name is cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline.

Molecular Properties

Compound Namecumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline
PubChem CID159015091
Molecular FormulaC275H399N5O4S2
Molecular Weight3903.38 g/mol
Exact Mass3900.06
IUPAC Namecumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline
SMILESC.C.C.C.C=C(C)Nc1ccc(C(C)C)cc1.CC(=O)c1ccc(C(C)C)cc1.CC(C)C1CC1c1ccccc1.CC(C)C1CCCCC1.CC(C)C1Cc2ccccc2C1.CC(C)CCc1ccccc1.CC(C)CCc1ccccc1.CC(C)CCc1cccs1.CC(C)CCc1ccncc1.CC(C)N1CCCCC1.CC(C)c1ccc(-c2cscn2)cc1.CC(C)c1ccc(C2CCCCC2)cc1.CC(C)c1ccc(N2CCCCC2)cc1.CC(C)c1ccc(Oc2ccccc2)cc1.CC(C)c1ccc2c(c1)OCO2.CC(C)c1ccccc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1C.Cc1cccc(C(C)C)c1.Cc1ccccc1C(C)C
InChIInChI=1S/C15H16O.C15H22.C14H21N.C12H13NS.C12H17N.2C12H16.C11H14O.3C11H16.C10H15N.C10H12O2.8C10H14.C9H14S.C9H18.C9H12.C8H17N.4CH4/c1-12(2)13-8-10-15(11-9-13)16-14-6-4-3-5-7-14;1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14;1-12(2)13-6-8-14(9-7-13)15-10-4-3-5-11-15;1-9(2)10-3-5-11(6-4-10)12-7-14-8-13-12;1-9(2)11-5-7-12(8-6-11)13-10(3)4;1-9(2)12-7-10-5-3-4-6-11(10)8-12;1-9(2)11-8-12(11)10-6-4-3-5-7-10;1-8(2)10-4-6-11(7-5-10)9(3)12;1-8(2)11-6-5-9(3)10(4)7-11;2*1-10(2)8-9-11-6-4-3-5-7-11;1-9(2)3-4-10-5-7-11-8-6-10;1-7(2)8-3-4-9-10(5-8)12-6-11-9;6*1-8(2)10-6-4-9(3)5-7-10;1-8(2)10-6-4-5-9(3)7-10;1-8(2)10-7-5-4-6-9(10)3;1-8(2)5-6-9-4-3-7-10-9;3*1-8(2)9-6-4-3-5-7-9;;;;/h3-12H,1-2H3;8-12,14H,3-7H2,1-2H3;6-9,12H,3-5,10-11H2,1-2H3;3-9H,1-2H3;5-9,13H,3H2,1-2,4H3;3-6,9,12H,7-8H2,1-2H3;3-7,9,11-12H,8H2,1-2H3;4-8H,1-3H3;5-8H,1-4H3;2*3-7,10H,8-9H2,1-2H3;5-9H,3-4H2,1-2H3;3-5,7H,6H2,1-2H3;8*4-8H,1-3H3;3-4,7-8H,5-6H2,1-2H3;8-9H,3-7H2,1-2H3;3-8H,1-2H3;8H,3-7H2,1-2H3;4*1H4
InChIKeyJSZHQMULTLOQCK-UHFFFAOYSA-N
XLogP84.39
TPSA89.05 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds42
Heavy Atoms286
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003903.38
LogP ≤ 584.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline?
The IUPAC name of cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline (CID 159015091) is cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline.
What is the SMILES notation for cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline?
The canonical SMILES for cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline is C.C.C.C.C=C(C)Nc1ccc(C(C)C)cc1.CC(=O)c1ccc(C(C)C)cc1.CC(C)C1CC1c1ccccc1.CC(C)C1CCCCC1.CC(C)C1Cc2ccccc2C1.CC(C)CCc1ccccc1.CC(C)CCc1ccccc1.CC(C)CCc1cccs1.CC(C)CCc1ccncc1.CC(C)N1CCCCC1.CC(C)c1ccc(-c2cscn2)cc1.CC(C)c1ccc(C2CCCCC2)cc1.CC(C)c1ccc(N2CCCCC2)cc1.CC(C)c1ccc(Oc2ccccc2)cc1.CC(C)c1ccc2c(c1)OCO2.CC(C)c1ccccc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1C.Cc1cccc(C(C)C)c1.Cc1ccccc1C(C)C.
What is the InChIKey of cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline?
The InChIKey is JSZHQMULTLOQCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O.C15H22.C14H21N.C12H13NS.C12H17N.2C12H16.C11H14O.3C11H16.C10H15N.C10H12O2.8C10H14.C9H14S.C9H18.C9H12.C8H17N.4CH4/c1-12(2)13-8-10-15(11-9-13)16-14-6-4-3-5-7-14;1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14;1-12(2)13-6-8-14(9-7-13)15-10-4-3-5-11-15;1-9(2)10-3-5-11(6-4-10)12-7-14-8-13-12;1-9(2)11-5-7-12(8-6-11)13-10(3)4;1-9(2)12-7-10-5-3-4-6-11(10)8-12;1-9(2)11-8-12(11)10-6-4-3-5-7-10;1-8(2)10-4-6-11(7-5-10)9(3)12;1-8(2)11-6-5-9(3)10(4)7-11;2*1-10(2)8-9-11-6-4-3-5-7-11;1-9(2)3-4-10-5-7-11-8-6-10;1-7(2)8-3-4-9-10(5-8)12-6-11-9;6*1-8(2)10-6-4-9(3)5-7-10;1-8(2)10-6-4-5-9(3)7-10;1-8(2)10-7-5-4-6-9(10)3;1-8(2)5-6-9-4-3-7-10-9;3*1-8(2)9-6-4-3-5-7-9;;;;/h3-12H,1-2H3;8-12,14H,3-7H2,1-2H3;6-9,12H,3-5,10-11H2,1-2H3;3-9H,1-2H3;5-9,13H,3H2,1-2,4H3;3-6,9,12H,7-8H2,1-2H3;3-7,9,11-12H,8H2,1-2H3;4-8H,1-3H3;5-8H,1-4H3;2*3-7,10H,8-9H2,1-2H3;5-9H,3-4H2,1-2H3;3-5,7H,6H2,1-2H3;8*4-8H,1-3H3;3-4,7-8H,5-6H2,1-2H3;8-9H,3-7H2,1-2H3;3-8H,1-2H3;8H,3-7H2,1-2H3;4*1H4.
What are the key properties of cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline?
cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline has a molecular weight of 3903.38 g/mol, XLogP of 84.39, 42 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for cumene;1-cyclohexyl-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane;bis(3-methylbutylbenzene);4-(3-methylbutyl)pyridine;2-(3-methylbutyl)thiophene;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;hexakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclohexane;(2-propan-2-ylcyclopropyl)benzene;2-propan-2-yl-2,3-dihydro-1H-indene;1-(4-propan-2-ylphenyl)ethanone;1-(4-propan-2-ylphenyl)piperidine;4-(4-propan-2-ylphenyl)-1,3-thiazole;1-propan-2-ylpiperidine;4-propan-2-yl-N-prop-1-en-2-ylaniline is sourced from PubChem (CID 159015091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).