2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide

C182H238Cl2F10N2O28S5 — CID 159269931

IUPAC2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide
SMILESCCCOc1ccc(C)cc1.CCNS(=O)(=O)c1ccc(C)cc1.CCS(=O)(=O)c1ccc(C)cc1.CCc1ccc(C)cc1OC.COc1c(C)cc(C)cc1C.COc1cc(C)ccc1OC(F)F.COc1cc(OC(F)(F)F)ccc1C.COc1cc(S(C)(=O)=O)ccc1C.COc1ccc(C)c(OC(F)(F)F)c1.Cc1ccc(OC(C)C)c(Cl)c1.Cc1ccc(OC(C)C)c(F)c1.Cc1ccc(OC(C)C)cc1.Cc1ccc(OC(C)C)cc1Cl.Cc1ccc(OC(C)C)cc1F.Cc1ccc(S(=O)(=O)N(C)C)cc1.Cc1ccc(S(C)(=O)=O)c(C)c1.Cc1cccc(C(C)C)c1O.Cc1cccc2c1OCCC2.Cc1ccccc1OC(C)C
InChIInChI=1S/2C10H13ClO.2C10H13FO.C10H12O.6C10H14O.2C9H9F3O2.C9H10F2O2.2C9H13NO2S.C9H12O3S.2C9H12O2S/c1-7(2)12-9-5-4-8(3)10(11)6-9;1-7(2)12-10-5-4-8(3)6-9(10)11;1-7(2)12-9-5-4-8(3)10(11)6-9;1-7(2)12-10-5-4-8(3)6-9(10)11;1-8-4-2-5-9-6-3-7-11-10(8)9;1-7-5-8(2)10(11-4)9(3)6-7;1-8(2)11-10-6-4-9(3)5-7-10;1-8(2)11-10-7-5-4-6-9(10)3;1-7(2)9-6-4-5-8(3)10(9)11;1-4-9-6-5-8(2)7-10(9)11-3;1-3-8-11-10-6-4-9(2)5-7-10;1-6-3-4-7(5-8(6)13-2)14-9(10,11)12;1-6-3-4-7(13-2)5-8(6)14-9(10,11)12;1-6-3-4-7(13-9(10)11)8(5-6)12-2;1-8-4-6-9(7-5-8)13(11,12)10(2)3;1-3-10-13(11,12)9-6-4-8(2)5-7-9;1-7-4-5-8(13(3,10)11)6-9(7)12-2;1-7-4-5-9(8(2)6-7)12(3,10)11;1-3-12(10,11)9-6-4-8(2)5-7-9/h4*4-7H,1-3H3;2,4-5H,3,6-7H2,1H3;5-6H,1-4H3;2*4-8H,1-3H3;4-7,11H,1-3H3;5-7H,4H2,1-3H3;4-7H,3,8H2,1-2H3;2*3-5H,1-2H3;3-5,9H,1-2H3;4-7H,1-3H3;4-7,10H,3H2,1-2H3;4-6H,1-3H3;4-6H,1-3H3;4-7H,3H2,1-2H3
InChIKeyKXOQKTTWGMNCQL-UHFFFAOYSA-N
MW3323.11 g/mol
LogP47.24
Rot. Bonds36

About 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide

2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide (PubChem CID 159269931) has the molecular formula C182H238Cl2F10N2O28S5 and a molecular weight of 3323.11 g/mol. Its IUPAC name is 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide.

Molecular Properties

Compound Name2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide
PubChem CID159269931
Molecular FormulaC182H238Cl2F10N2O28S5
Molecular Weight3323.11 g/mol
Exact Mass3319.51
IUPAC Name2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide
SMILESCCCOc1ccc(C)cc1.CCNS(=O)(=O)c1ccc(C)cc1.CCS(=O)(=O)c1ccc(C)cc1.CCc1ccc(C)cc1OC.COc1c(C)cc(C)cc1C.COc1cc(C)ccc1OC(F)F.COc1cc(OC(F)(F)F)ccc1C.COc1cc(S(C)(=O)=O)ccc1C.COc1ccc(C)c(OC(F)(F)F)c1.Cc1ccc(OC(C)C)c(Cl)c1.Cc1ccc(OC(C)C)c(F)c1.Cc1ccc(OC(C)C)cc1.Cc1ccc(OC(C)C)cc1Cl.Cc1ccc(OC(C)C)cc1F.Cc1ccc(S(=O)(=O)N(C)C)cc1.Cc1ccc(S(C)(=O)=O)c(C)c1.Cc1cccc(C(C)C)c1O.Cc1cccc2c1OCCC2.Cc1ccccc1OC(C)C
InChIInChI=1S/2C10H13ClO.2C10H13FO.C10H12O.6C10H14O.2C9H9F3O2.C9H10F2O2.2C9H13NO2S.C9H12O3S.2C9H12O2S/c1-7(2)12-9-5-4-8(3)10(11)6-9;1-7(2)12-10-5-4-8(3)6-9(10)11;1-7(2)12-9-5-4-8(3)10(11)6-9;1-7(2)12-10-5-4-8(3)6-9(10)11;1-8-4-2-5-9-6-3-7-11-10(8)9;1-7-5-8(2)10(11-4)9(3)6-7;1-8(2)11-10-6-4-9(3)5-7-10;1-8(2)11-10-7-5-4-6-9(10)3;1-7(2)9-6-4-5-8(3)10(9)11;1-4-9-6-5-8(2)7-10(9)11-3;1-3-8-11-10-6-4-9(2)5-7-10;1-6-3-4-7(5-8(6)13-2)14-9(10,11)12;1-6-3-4-7(13-2)5-8(6)14-9(10,11)12;1-6-3-4-7(13-9(10)11)8(5-6)12-2;1-8-4-6-9(7-5-8)13(11,12)10(2)3;1-3-10-13(11,12)9-6-4-8(2)5-7-9;1-7-4-5-8(13(3,10)11)6-9(7)12-2;1-7-4-5-9(8(2)6-7)12(3,10)11;1-3-12(10,11)9-6-4-8(2)5-7-9/h4*4-7H,1-3H3;2,4-5H,3,6-7H2,1H3;5-6H,1-4H3;2*4-8H,1-3H3;4-7,11H,1-3H3;5-7H,4H2,1-3H3;4-7H,3,8H2,1-2H3;2*3-5H,1-2H3;3-5,9H,1-2H3;4-7H,1-3H3;4-7,10H,3H2,1-2H3;4-6H,1-3H3;4-6H,1-3H3;4-7H,3H2,1-2H3
InChIKeyKXOQKTTWGMNCQL-UHFFFAOYSA-N
XLogP47.24
TPSA363.11 Ų
H-Bond Donors2
H-Bond Acceptors28
Rotatable Bonds36
Heavy Atoms229
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003323.11
LogP ≤ 547.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1028

Analyze 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide 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 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide?
The IUPAC name of 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide (CID 159269931) is 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide.
What is the SMILES notation for 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide?
The canonical SMILES for 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide is CCCOc1ccc(C)cc1.CCNS(=O)(=O)c1ccc(C)cc1.CCS(=O)(=O)c1ccc(C)cc1.CCc1ccc(C)cc1OC.COc1c(C)cc(C)cc1C.COc1cc(C)ccc1OC(F)F.COc1cc(OC(F)(F)F)ccc1C.COc1cc(S(C)(=O)=O)ccc1C.COc1ccc(C)c(OC(F)(F)F)c1.Cc1ccc(OC(C)C)c(Cl)c1.Cc1ccc(OC(C)C)c(F)c1.Cc1ccc(OC(C)C)cc1.Cc1ccc(OC(C)C)cc1Cl.Cc1ccc(OC(C)C)cc1F.Cc1ccc(S(=O)(=O)N(C)C)cc1.Cc1ccc(S(C)(=O)=O)c(C)c1.Cc1cccc(C(C)C)c1O.Cc1cccc2c1OCCC2.Cc1ccccc1OC(C)C.
What is the InChIKey of 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide?
The InChIKey is KXOQKTTWGMNCQL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H13ClO.2C10H13FO.C10H12O.6C10H14O.2C9H9F3O2.C9H10F2O2.2C9H13NO2S.C9H12O3S.2C9H12O2S/c1-7(2)12-9-5-4-8(3)10(11)6-9;1-7(2)12-10-5-4-8(3)6-9(10)11;1-7(2)12-9-5-4-8(3)10(11)6-9;1-7(2)12-10-5-4-8(3)6-9(10)11;1-8-4-2-5-9-6-3-7-11-10(8)9;1-7-5-8(2)10(11-4)9(3)6-7;1-8(2)11-10-6-4-9(3)5-7-10;1-8(2)11-10-7-5-4-6-9(10)3;1-7(2)9-6-4-5-8(3)10(9)11;1-4-9-6-5-8(2)7-10(9)11-3;1-3-8-11-10-6-4-9(2)5-7-10;1-6-3-4-7(5-8(6)13-2)14-9(10,11)12;1-6-3-4-7(13-2)5-8(6)14-9(10,11)12;1-6-3-4-7(13-9(10)11)8(5-6)12-2;1-8-4-6-9(7-5-8)13(11,12)10(2)3;1-3-10-13(11,12)9-6-4-8(2)5-7-9;1-7-4-5-8(13(3,10)11)6-9(7)12-2;1-7-4-5-9(8(2)6-7)12(3,10)11;1-3-12(10,11)9-6-4-8(2)5-7-9/h4*4-7H,1-3H3;2,4-5H,3,6-7H2,1H3;5-6H,1-4H3;2*4-8H,1-3H3;4-7,11H,1-3H3;5-7H,4H2,1-3H3;4-7H,3,8H2,1-2H3;2*3-5H,1-2H3;3-5,9H,1-2H3;4-7H,1-3H3;4-7,10H,3H2,1-2H3;4-6H,1-3H3;4-6H,1-3H3;4-7H,3H2,1-2H3.
What are the key properties of 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide?
2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide has a molecular weight of 3323.11 g/mol, XLogP of 47.24, 36 rotatable bonds, 2 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1-methyl-4-propan-2-yloxybenzene;2-chloro-4-methyl-1-propan-2-yloxybenzene;1-(difluoromethoxy)-2-methoxy-4-methylbenzene;2,4-dimethyl-1-methylsulfonylbenzene;1-ethyl-2-methoxy-4-methylbenzene;N-ethyl-4-methylbenzenesulfonamide;1-ethylsulfonyl-4-methylbenzene;2-fluoro-1-methyl-4-propan-2-yloxybenzene;2-fluoro-4-methyl-1-propan-2-yloxybenzene;2-methoxy-1-methyl-4-methylsulfonylbenzene;2-methoxy-1-methyl-4-(trifluoromethoxy)benzene;4-methoxy-1-methyl-2-(trifluoromethoxy)benzene;2-methoxy-1,3,5-trimethylbenzene;8-methyl-3,4-dihydro-2H-chromene;1-methyl-2-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene;2-methyl-6-propan-2-ylphenol;1-methyl-4-propoxybenzene;N,N,4-trimethylbenzenesulfonamide is sourced from PubChem (CID 159269931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).