4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine

C124H152Cl4N18O17S3 — CID 157416223

IUPAC4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine
SMILESCCc1ccc(C)cc1.COc1ccc(C)c(C(N)=O)c1.COc1ccc(C)c(O)c1.COc1ccc(C)c(S(N)(=O)=O)c1.COc1ccc(C)cc1O.Cc1cc(C(N)=O)ccc1O.Cc1cc(Cl)ccc1S(N)(=O)=O.Cc1cc(Cl)ccn1.Cc1cc(N)ccn1.Cc1ccc(Cl)c(N)n1.Cc1ccc(Cl)cn1.Cc1cccc(C(N)=O)c1.Cc1cccc(CN)c1.Cc1cccc(N)n1.Cc1ccccc1C(N)=O.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(N)c1
InChIInChI=1S/C9H11NO2.C9H12.C8H11NO3S.C8H9NO2.2C8H9NO.C8H11N.2C8H10O2.C7H8ClNO2S.C7H9NO2S.C6H7ClN2.2C6H6ClN.3C6H8N2/c1-6-3-4-7(12-2)5-8(6)9(10)11;1-3-9-6-4-8(2)5-7-9;1-6-3-4-7(12-2)5-8(6)13(9,10)11;1-5-4-6(8(9)11)2-3-7(5)10;1-6-3-2-4-7(5-6)8(9)10;1-6-4-2-3-5-7(6)8(9)10;1-7-3-2-4-8(5-7)6-9;1-6-3-4-7(10-2)5-8(6)9;1-6-3-4-8(10-2)7(9)5-6;1-5-4-6(8)2-3-7(5)12(9,10)11;1-6-4-2-3-5-7(6)11(8,9)10;1-4-2-3-5(7)6(8)9-4;1-5-4-6(7)2-3-8-5;1-5-2-3-6(7)4-8-5;1-5-4-6(7)2-3-8-5;1-5-2-3-8-6(7)4-5;1-5-3-2-4-6(7)8-5/h3-5H,1-2H3,(H2,10,11);4-7H,3H2,1-2H3;3-5H,1-2H3,(H2,9,10,11);2-4,10H,1H3,(H2,9,11);2*2-5H,1H3,(H2,9,10);2-5H,6,9H2,1H3;2*3-5,9H,1-2H3;2-4H,1H3,(H2,9,10,11);2-5H,1H3,(H2,8,9,10);2-3H,1H3,(H2,8,9);2*2-4H,1H3;3*2-4H,1H3,(H2,7,8)
InChIKeyBOWMZHCIGMJDJY-UHFFFAOYSA-N
MW2404.70 g/mol
LogP22.74
Rot. Bonds13

About 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine

4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine (PubChem CID 157416223) has the molecular formula C124H152Cl4N18O17S3 and a molecular weight of 2404.70 g/mol. Its IUPAC name is 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine.

Molecular Properties

Compound Name4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine
PubChem CID157416223
Molecular FormulaC124H152Cl4N18O17S3
Molecular Weight2404.70 g/mol
Exact Mass2400.95
IUPAC Name4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine
SMILESCCc1ccc(C)cc1.COc1ccc(C)c(C(N)=O)c1.COc1ccc(C)c(O)c1.COc1ccc(C)c(S(N)(=O)=O)c1.COc1ccc(C)cc1O.Cc1cc(C(N)=O)ccc1O.Cc1cc(Cl)ccc1S(N)(=O)=O.Cc1cc(Cl)ccn1.Cc1cc(N)ccn1.Cc1ccc(Cl)c(N)n1.Cc1ccc(Cl)cn1.Cc1cccc(C(N)=O)c1.Cc1cccc(CN)c1.Cc1cccc(N)n1.Cc1ccccc1C(N)=O.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(N)c1
InChIInChI=1S/C9H11NO2.C9H12.C8H11NO3S.C8H9NO2.2C8H9NO.C8H11N.2C8H10O2.C7H8ClNO2S.C7H9NO2S.C6H7ClN2.2C6H6ClN.3C6H8N2/c1-6-3-4-7(12-2)5-8(6)9(10)11;1-3-9-6-4-8(2)5-7-9;1-6-3-4-7(12-2)5-8(6)13(9,10)11;1-5-4-6(8(9)11)2-3-7(5)10;1-6-3-2-4-7(5-6)8(9)10;1-6-4-2-3-5-7(6)8(9)10;1-7-3-2-4-8(5-7)6-9;1-6-3-4-7(10-2)5-8(6)9;1-6-3-4-8(10-2)7(9)5-6;1-5-4-6(8)2-3-7(5)12(9,10)11;1-6-4-2-3-5-7(6)11(8,9)10;1-4-2-3-5(7)6(8)9-4;1-5-4-6(7)2-3-8-5;1-5-2-3-6(7)4-8-5;1-5-4-6(7)2-3-8-5;1-5-2-3-8-6(7)4-5;1-5-3-2-4-6(7)8-5/h3-5H,1-2H3,(H2,10,11);4-7H,3H2,1-2H3;3-5H,1-2H3,(H2,9,10,11);2-4,10H,1H3,(H2,9,11);2*2-5H,1H3,(H2,9,10);2-5H,6,9H2,1H3;2*3-5,9H,1-2H3;2-4H,1H3,(H2,9,10,11);2-5H,1H3,(H2,8,9,10);2-3H,1H3,(H2,8,9);2*2-4H,1H3;3*2-4H,1H3,(H2,7,8)
InChIKeyBOWMZHCIGMJDJY-UHFFFAOYSA-N
XLogP22.74
TPSA657.89 Ų
H-Bond Donors15
H-Bond Acceptors28
Rotatable Bonds13
Heavy Atoms166
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002404.70
LogP ≤ 522.74
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1028

Analyze 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine?
The IUPAC name of 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine (CID 157416223) is 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine.
What is the SMILES notation for 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine?
The canonical SMILES for 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine is CCc1ccc(C)cc1.COc1ccc(C)c(C(N)=O)c1.COc1ccc(C)c(O)c1.COc1ccc(C)c(S(N)(=O)=O)c1.COc1ccc(C)cc1O.Cc1cc(C(N)=O)ccc1O.Cc1cc(Cl)ccc1S(N)(=O)=O.Cc1cc(Cl)ccn1.Cc1cc(N)ccn1.Cc1ccc(Cl)c(N)n1.Cc1ccc(Cl)cn1.Cc1cccc(C(N)=O)c1.Cc1cccc(CN)c1.Cc1cccc(N)n1.Cc1ccccc1C(N)=O.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(N)c1.
What is the InChIKey of 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine?
The InChIKey is BOWMZHCIGMJDJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2.C9H12.C8H11NO3S.C8H9NO2.2C8H9NO.C8H11N.2C8H10O2.C7H8ClNO2S.C7H9NO2S.C6H7ClN2.2C6H6ClN.3C6H8N2/c1-6-3-4-7(12-2)5-8(6)9(10)11;1-3-9-6-4-8(2)5-7-9;1-6-3-4-7(12-2)5-8(6)13(9,10)11;1-5-4-6(8(9)11)2-3-7(5)10;1-6-3-2-4-7(5-6)8(9)10;1-6-4-2-3-5-7(6)8(9)10;1-7-3-2-4-8(5-7)6-9;1-6-3-4-7(10-2)5-8(6)9;1-6-3-4-8(10-2)7(9)5-6;1-5-4-6(8)2-3-7(5)12(9,10)11;1-6-4-2-3-5-7(6)11(8,9)10;1-4-2-3-5(7)6(8)9-4;1-5-4-6(7)2-3-8-5;1-5-2-3-6(7)4-8-5;1-5-4-6(7)2-3-8-5;1-5-2-3-8-6(7)4-5;1-5-3-2-4-6(7)8-5/h3-5H,1-2H3,(H2,10,11);4-7H,3H2,1-2H3;3-5H,1-2H3,(H2,9,10,11);2-4,10H,1H3,(H2,9,11);2*2-5H,1H3,(H2,9,10);2-5H,6,9H2,1H3;2*3-5,9H,1-2H3;2-4H,1H3,(H2,9,10,11);2-5H,1H3,(H2,8,9,10);2-3H,1H3,(H2,8,9);2*2-4H,1H3;3*2-4H,1H3,(H2,7,8).
What are the key properties of 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine?
4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine has a molecular weight of 2404.70 g/mol, XLogP of 22.74, 13 rotatable bonds, 15 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methylbenzenesulfonamide;3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;1-ethyl-4-methylbenzene;4-hydroxy-3-methylbenzamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(3-methylphenyl)methanamine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine is sourced from PubChem (CID 157416223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).