[4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene

C165H215F4N21O12S2 — CID 158320366

About [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene

[4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene (PubChem CID 158320366) has the molecular formula C165H215F4N21O12S2 and a molecular weight of 2824.80 g/mol. Its IUPAC name is [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene.

Molecular Properties

• Compound Name: [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene
• PubChem CID: 158320366
• Molecular Formula: C165H215F4N21O12S2
• Molecular Weight: 2824.80 g/mol
• Exact Mass: 2822.62
• IUPAC Name: [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene
• SMILES: COc1ccc(C)c(C(N)=O)c1.COc1ccc(C)c(CN)c1.COc1ccc(C)c(S(N)(=O)=O)c1.COc1ccc(C)cc1.Cc1c(F)cccc1CN.Cc1cc(CO)ccc1CN.Cc1cc(F)ccc1CN.Cc1ccc(C)c(N)c1.Cc1ccc(C)c(N)n1.Cc1ccc(C)cc1.Cc1ccc(CN)cc1.Cc1ccc(F)cc1CN.Cc1cccc(C(N)=O)c1.Cc1cccc(C)c1.Cc1cccc(CN)c1.Cc1cccc(F)c1CN.Cc1cccc(N)n1.Cc1ccccc1C(N)=O.Cc1ccccc1CN.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(N)c1
• InChI: InChI=1S/C9H11NO2.2C9H13NO.4C8H10FN.C8H11NO3S.2C8H9NO.4C8H11N.C8H10O.2C8H10.C7H10N2.C7H9NO2S.2C6H8N2/c1-6-3-4-7(12-2)5-8(6)9(10)11;1-7-3-4-9(11-2)5-8(7)6-10;1-7-4-8(6-11)2-3-9(7)5-10;1-6-4-8(9)3-2-7(6)5-10;1-6-2-3-8(9)4-7(6)5-10;1-6-7(5-10)3-2-4-8(6)9;1-6-3-2-4-8(9)7(6)5-10;1-6-3-4-7(12-2)5-8(6)13(9,10)11;1-6-3-2-4-7(5-6)8(9)10;1-6-4-2-3-5-7(6)8(9)10;1-6-3-4-7(2)8(9)5-6;1-7-2-4-8(6-9)5-3-7;1-7-3-2-4-8(5-7)6-9;1-7-4-2-3-5-8(7)6-9;1-7-3-5-8(9-2)6-4-7;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-5-3-4-6(2)9-7(5)8;1-6-4-2-3-5-7(6)11(8,9)10;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);3-5H,6,10H2,1-2H3;2-4,11H,5-6,10H2,1H3;4*2-4H,5,10H2,1H3;3-5H,1-2H3,(H2,9,10,11);2*2-5H,1H3,(H2,9,10);3-5H,9H2,1-2H3;3*2-5H,6,9H2,1H3;3-6H,1-2H3;2*3-6H,1-2H3;3-4H,1-2H3,(H2,8,9);2-5H,1H3,(H2,8,9,10);2*2-4H,1H3,(H2,7,8)
• InChIKey: GOTSBYGFQSHINS-UHFFFAOYSA-N
• XLogP: 29.45
• TPSA: 683.67 Ų
• H-Bond Donors: 19
• H-Bond Acceptors: 28
• Rotatable Bonds: 19
• Heavy Atoms: 204
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2824.80
LogP ≤ 5	29.45
H-Bond Donors ≤ 5	19
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene?

The IUPAC name of [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene (CID 158320366) is [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene.

What is the SMILES notation for [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene?

The canonical SMILES for [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene is COc1ccc(C)c(C(N)=O)c1.COc1ccc(C)c(CN)c1.COc1ccc(C)c(S(N)(=O)=O)c1.COc1ccc(C)cc1.Cc1c(F)cccc1CN.Cc1cc(CO)ccc1CN.Cc1cc(F)ccc1CN.Cc1ccc(C)c(N)c1.Cc1ccc(C)c(N)n1.Cc1ccc(C)cc1.Cc1ccc(CN)cc1.Cc1ccc(F)cc1CN.Cc1cccc(C(N)=O)c1.Cc1cccc(C)c1.Cc1cccc(CN)c1.Cc1cccc(F)c1CN.Cc1cccc(N)n1.Cc1ccccc1C(N)=O.Cc1ccccc1CN.Cc1ccccc1S(N)(=O)=O.Cc1ccnc(N)c1.

What is the InChIKey of [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene?

The InChIKey is GOTSBYGFQSHINS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2.2C9H13NO.4C8H10FN.C8H11NO3S.2C8H9NO.4C8H11N.C8H10O.2C8H10.C7H10N2.C7H9NO2S.2C6H8N2/c1-6-3-4-7(12-2)5-8(6)9(10)11;1-7-3-4-9(11-2)5-8(7)6-10;1-7-4-8(6-11)2-3-9(7)5-10;1-6-4-8(9)3-2-7(6)5-10;1-6-2-3-8(9)4-7(6)5-10;1-6-7(5-10)3-2-4-8(6)9;1-6-3-2-4-8(9)7(6)5-10;1-6-3-4-7(12-2)5-8(6)13(9,10)11;1-6-3-2-4-7(5-6)8(9)10;1-6-4-2-3-5-7(6)8(9)10;1-6-3-4-7(2)8(9)5-6;1-7-2-4-8(6-9)5-3-7;1-7-3-2-4-8(5-7)6-9;1-7-4-2-3-5-8(7)6-9;1-7-3-5-8(9-2)6-4-7;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-5-3-4-6(2)9-7(5)8;1-6-4-2-3-5-7(6)11(8,9)10;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);3-5H,6,10H2,1-2H3;2-4,11H,5-6,10H2,1H3;4*2-4H,5,10H2,1H3;3-5H,1-2H3,(H2,9,10,11);2*2-5H,1H3,(H2,9,10);3-5H,9H2,1-2H3;3*2-5H,6,9H2,1H3;3-6H,1-2H3;2*3-6H,1-2H3;3-4H,1-2H3,(H2,8,9);2-5H,1H3,(H2,8,9,10);2*2-4H,1H3,(H2,7,8).

What are the key properties of [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene?

[4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene has a molecular weight of 2824.80 g/mol, XLogP of 29.45, 19 rotatable bonds, 19 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for [4-(aminomethyl)-3-methylphenyl]methanol;2,5-dimethylaniline;3,6-dimethylpyridin-2-amine;(2-fluoro-6-methylphenyl)methanamine;(3-fluoro-2-methylphenyl)methanamine;(4-fluoro-2-methylphenyl)methanamine;(5-fluoro-2-methylphenyl)methanamine;5-methoxy-2-methylbenzamide;1-methoxy-4-methylbenzene;5-methoxy-2-methylbenzenesulfonamide;(5-methoxy-2-methylphenyl)methanamine;2-methylbenzamide;3-methylbenzamide;2-methylbenzenesulfonamide;(2-methylphenyl)methanamine;(3-methylphenyl)methanamine;(4-methylphenyl)methanamine;4-methylpyridin-2-amine;6-methylpyridin-2-amine;1,3-xylene;1,4-xylene is sourced from PubChem (CID 158320366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).