3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine

C169H197Cl4N29O22S3 — CID 157345849

About 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine

3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine (PubChem CID 157345849) has the molecular formula C169H197Cl4N29O22S3 and a molecular weight of 3224.63 g/mol. Its IUPAC name is 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine.

Molecular Properties

• Compound Name: 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine
• PubChem CID: 157345849
• Molecular Formula: C169H197Cl4N29O22S3
• Molecular Weight: 3224.63 g/mol
• Exact Mass: 3220.31
• IUPAC Name: 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine
• SMILES: 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)ccn1.Cc1cc(N)ccn1.Cc1ccc(C2=NNC(=O)C2)cc1.Cc1ccc(Cl)c(N)n1.Cc1ccc(Cl)cn1.Cc1ccc(Cl)s1.Cc1cccc(C(N)=NCO)c1.Cc1cccc(C(N)=NO)c1.Cc1cccc(C(N)=O)c1.Cc1cccc(C2=NNC(=O)C2)c1.Cc1cccc(C2=NOC(=O)C2)c1.Cc1cccc(CN)c1.Cc1cccc(N)n1.Cc1ccccc1-c1n[nH]c(=O)[nH]1.Cc1ccccc1C(N)=O.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(N)c1
• InChI: InChI=1S/2C10H10N2O.C10H9NO2.C9H9N3O.C9H12N2O.C9H11NO2.C8H10N2O.C8H11NO3S.C8H9NO2.2C8H9NO.C8H11N.2C8H10O2.C7H9NO2S.C6H7ClN2.2C6H6ClN.3C6H8N2.C5H5ClS/c1-7-2-4-8(5-3-7)9-6-10(13)12-11-9;1-7-3-2-4-8(5-7)9-6-10(13)12-11-9;1-7-3-2-4-8(5-7)9-6-10(12)13-11-9;1-6-4-2-3-5-7(6)8-10-9(13)12-11-8;1-7-3-2-4-8(5-7)9(10)11-6-12;1-6-3-4-7(12-2)5-8(6)9(10)11;1-6-3-2-4-7(5-6)8(9)10-11;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;1-6-4-2-3-5-7(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;1-4-2-3-5(6)7-4/h2*2-5H,6H2,1H3,(H,12,13);2-5H,6H2,1H3;2-5H,1H3,(H2,10,11,12,13);2-5,12H,6H2,1H3,(H2,10,11);3-5H,1-2H3,(H2,10,11);2-5,11H,1H3,(H2,9,10);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;2-5H,1H3,(H2,8,9,10);2-3H,1H3,(H2,8,9);2*2-4H,1H3;3*2-4H,1H3,(H2,7,8);2-3H,1H3
• InChIKey: BGYOSJZXMVPRFR-UHFFFAOYSA-N
• XLogP: 28.49
• TPSA: 898.07 Ų
• H-Bond Donors: 22
• H-Bond Acceptors: 40
• Rotatable Bonds: 18
• Heavy Atoms: 227
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3224.63
LogP ≤ 5	28.49
H-Bond Donors ≤ 5	22
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine?

The IUPAC name of 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine (CID 157345849) is 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine.

What is the SMILES notation for 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine?

The canonical SMILES for 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine is 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)ccn1.Cc1cc(N)ccn1.Cc1ccc(C2=NNC(=O)C2)cc1.Cc1ccc(Cl)c(N)n1.Cc1ccc(Cl)cn1.Cc1ccc(Cl)s1.Cc1cccc(C(N)=NCO)c1.Cc1cccc(C(N)=NO)c1.Cc1cccc(C(N)=O)c1.Cc1cccc(C2=NNC(=O)C2)c1.Cc1cccc(C2=NOC(=O)C2)c1.Cc1cccc(CN)c1.Cc1cccc(N)n1.Cc1ccccc1-c1n[nH]c(=O)[nH]1.Cc1ccccc1C(N)=O.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(N)c1.

What is the InChIKey of 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine?

The InChIKey is BGYOSJZXMVPRFR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H10N2O.C10H9NO2.C9H9N3O.C9H12N2O.C9H11NO2.C8H10N2O.C8H11NO3S.C8H9NO2.2C8H9NO.C8H11N.2C8H10O2.C7H9NO2S.C6H7ClN2.2C6H6ClN.3C6H8N2.C5H5ClS/c1-7-2-4-8(5-3-7)9-6-10(13)12-11-9;1-7-3-2-4-8(5-7)9-6-10(13)12-11-9;1-7-3-2-4-8(5-7)9-6-10(12)13-11-9;1-6-4-2-3-5-7(6)8-10-9(13)12-11-8;1-7-3-2-4-8(5-7)9(10)11-6-12;1-6-3-4-7(12-2)5-8(6)9(10)11;1-6-3-2-4-7(5-6)8(9)10-11;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;1-6-4-2-3-5-7(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;1-4-2-3-5(6)7-4/h2*2-5H,6H2,1H3,(H,12,13);2-5H,6H2,1H3;2-5H,1H3,(H2,10,11,12,13);2-5,12H,6H2,1H3,(H2,10,11);3-5H,1-2H3,(H2,10,11);2-5,11H,1H3,(H2,9,10);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;2-5H,1H3,(H2,8,9,10);2-3H,1H3,(H2,8,9);2*2-4H,1H3;3*2-4H,1H3,(H2,7,8);2-3H,1H3.

What are the key properties of 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine?

3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine has a molecular weight of 3224.63 g/mol, XLogP of 28.49, 18 rotatable bonds, 22 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-6-methylpyridin-2-amine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-5-methylthiophene;4-hydroxy-3-methylbenzamide;N'-hydroxy-3-methylbenzenecarboximidamide;N'-(hydroxymethyl)-3-methylbenzenecarboximidamide;5-methoxy-2-methylbenzamide;5-methoxy-2-methylbenzenesulfonamide;2-methoxy-5-methylphenol;5-methoxy-2-methylphenol;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;3-(3-methylphenyl)-1,4-dihydropyrazol-5-one;3-(4-methylphenyl)-1,4-dihydropyrazol-5-one;3-(2-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one;(3-methylphenyl)methanamine;3-(3-methylphenyl)-4H-1,2-oxazol-5-one;2-methylpyridin-4-amine;4-methylpyridin-2-amine;6-methylpyridin-2-amine is sourced from PubChem (CID 157345849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).