N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine

About N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine

N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine (PubChem CID 158388520) has the molecular formula C81H73F6N9O4 and a molecular weight of 1350.52 g/mol. Its IUPAC name is N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name	N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine
PubChem CID	158388520
Molecular Formula	C81H73F6N9O4
Molecular Weight	1350.52 g/mol
Exact Mass	1349.57
IUPAC Name	N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine
SMILES	CC(=O)Nc1ccc(-c2cccc(C)n2)cc1.COC(=O)c1ccc(-c2cccc(C)n2)cc1.Cc1cccc(-c2ccc(C(F)(F)F)cc2)n1.Cc1cccc(-c2ccc(N(C)C)cc2)n1.Cc1cccc(-c2ccc(OC(F)(F)F)cc2)n1.[C-]#[N+]c1ccc(-c2cccc(C)n2)cc1
InChI	InChI=1S/C14H14N2O.C14H16N2.C14H13NO2.C13H10F3NO.C13H10F3N.C13H10N2/c1-10-4-3-5-14(15-10)12-6-8-13(9-7-12)16-11(2)17;1-11-5-4-6-14(15-11)12-7-9-13(10-8-12)16(2)3;1-10-4-3-5-13(15-10)11-6-8-12(9-7-11)14(16)17-2;1-9-3-2-4-12(17-9)10-5-7-11(8-6-10)18-13(14,15)16;1-9-3-2-4-12(17-9)10-5-7-11(8-6-10)13(14,15)16;1-10-4-3-5-13(15-10)11-6-8-12(14-2)9-7-11/h3-9H,1-2H3,(H,16,17);4-10H,1-3H3;3-9H,1-2H3;2-8H,1H3;2-8H,1H3;3-9H,1H3
InChIKey	GWQSATDSFARGCZ-UHFFFAOYSA-N
XLogP	20.62
TPSA	149.57 Å²
H-Bond Donors	1
H-Bond Acceptors	11
Rotatable Bonds	10
Heavy Atoms	100
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1350.52
LogP ≤ 5	20.62
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

Structural Alerts	{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine?

The IUPAC name of N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine (CID 158388520) is N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine.

What is the SMILES notation for N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine?

The canonical SMILES for N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine is CC(=O)Nc1ccc(-c2cccc(C)n2)cc1.COC(=O)c1ccc(-c2cccc(C)n2)cc1.Cc1cccc(-c2ccc(C(F)(F)F)cc2)n1.Cc1cccc(-c2ccc(N(C)C)cc2)n1.Cc1cccc(-c2ccc(OC(F)(F)F)cc2)n1.[C-]#[N+]c1ccc(-c2cccc(C)n2)cc1.

What is the InChIKey of N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine?

The InChIKey is GWQSATDSFARGCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O.C14H16N2.C14H13NO2.C13H10F3NO.C13H10F3N.C13H10N2/c1-10-4-3-5-14(15-10)12-6-8-13(9-7-12)16-11(2)17;1-11-5-4-6-14(15-11)12-7-9-13(10-8-12)16(2)3;1-10-4-3-5-13(15-10)11-6-8-12(9-7-11)14(16)17-2;1-9-3-2-4-12(17-9)10-5-7-11(8-6-10)18-13(14,15)16;1-9-3-2-4-12(17-9)10-5-7-11(8-6-10)13(14,15)16;1-10-4-3-5-13(15-10)11-6-8-12(14-2)9-7-11/h3-9H,1-2H3,(H,16,17);4-10H,1-3H3;3-9H,1-2H3;2-8H,1H3;2-8H,1H3;3-9H,1H3.

What are the key properties of N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine?

Where does this data come from?

All data for N,N-dimethyl-4-(6-methyl-2-pyridinyl)aniline;2-(4-isocyanophenyl)-6-methylpyridine;methyl 4-(6-methyl-2-pyridinyl)benzoate;N-[4-(6-methyl-2-pyridinyl)phenyl]acetamide;2-methyl-6-[4-(trifluoromethoxy)phenyl]pyridine;2-methyl-6-[4-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 158388520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).