N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene

C141H148N6O3S2 — CID 159989866

About N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene

N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene (PubChem CID 159989866) has the molecular formula C141H148N6O3S2 and a molecular weight of 2038.91 g/mol. Its IUPAC name is N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene.

Molecular Properties

• Compound Name: N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene
• PubChem CID: 159989866
• Molecular Formula: C141H148N6O3S2
• Molecular Weight: 2038.91 g/mol
• Exact Mass: 2037.11
• IUPAC Name: N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene
• SMILES: C.C.CCc1ccc(-c2ccc(C)s2)cc1.Cc1ccc(-c2ccc(N(C)C)cc2)cc1.Cc1ccc(-c2ccc(N)cc2)cc1.Cc1ccc(-c2ccccc2)cn1.Cc1ccc(-c2ccccc2)s1.Cc1ccc(-c2ccccc2C)cc1.Cc1ccc(-n2cccn2)cc1.Cc1ccc(C(=O)c2ccccc2)cc1.Cc1ccc(N2CCOCC2)cc1.Cc1ccc(Oc2ccccc2)cc1.Cc1cccc(-c2ccccc2)c1
• InChI: InChI=1S/C15H17N.C14H12O.C14H14.C13H13N.C13H12O.C13H14S.C13H12.C12H11N.C11H15NO.C11H10S.C10H10N2.2CH4/c1-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(2)3;1-11-7-9-13(10-8-11)14(15)12-5-3-2-4-6-12;1-11-7-9-13(10-8-11)14-6-4-3-5-12(14)2;1-10-2-4-11(5-3-10)12-6-8-13(14)9-7-12;1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12;1-3-11-5-7-12(8-6-11)13-9-4-10(2)14-13;1-11-6-5-9-13(10-11)12-7-3-2-4-8-12;1-10-7-8-12(9-13-10)11-5-3-2-4-6-11;1-10-2-4-11(5-3-10)12-6-8-13-9-7-12;1-9-7-8-11(12-9)10-5-3-2-4-6-10;1-9-3-5-10(6-4-9)12-8-2-7-11-12;;/h4-11H,1-3H3;2-10H,1H3;3-10H,1-2H3;2-9H,14H2,1H3;2-10H,1H3;4-9H,3H2,1-2H3;2-10H,1H3;2-9H,1H3;2-5H,6-9H2,1H3;2*2-8H,1H3;2*1H4
• InChIKey: OGUUREAHUWBJBZ-UHFFFAOYSA-N
• XLogP: 37.97
• TPSA: 98.74 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 11
• Rotatable Bonds: 15
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2038.91
LogP ≤ 5	37.97
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene?

The IUPAC name of N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene (CID 159989866) is N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene.

What is the SMILES notation for N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene?

The canonical SMILES for N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene is C.C.CCc1ccc(-c2ccc(C)s2)cc1.Cc1ccc(-c2ccc(N(C)C)cc2)cc1.Cc1ccc(-c2ccc(N)cc2)cc1.Cc1ccc(-c2ccccc2)cn1.Cc1ccc(-c2ccccc2)s1.Cc1ccc(-c2ccccc2C)cc1.Cc1ccc(-n2cccn2)cc1.Cc1ccc(C(=O)c2ccccc2)cc1.Cc1ccc(N2CCOCC2)cc1.Cc1ccc(Oc2ccccc2)cc1.Cc1cccc(-c2ccccc2)c1.

What is the InChIKey of N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene?

The InChIKey is OGUUREAHUWBJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N.C14H12O.C14H14.C13H13N.C13H12O.C13H14S.C13H12.C12H11N.C11H15NO.C11H10S.C10H10N2.2CH4/c1-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(2)3;1-11-7-9-13(10-8-11)14(15)12-5-3-2-4-6-12;1-11-7-9-13(10-8-11)14-6-4-3-5-12(14)2;1-10-2-4-11(5-3-10)12-6-8-13(14)9-7-12;1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12;1-3-11-5-7-12(8-6-11)13-9-4-10(2)14-13;1-11-6-5-9-13(10-11)12-7-3-2-4-8-12;1-10-7-8-12(9-13-10)11-5-3-2-4-6-11;1-10-2-4-11(5-3-10)12-6-8-13-9-7-12;1-9-7-8-11(12-9)10-5-3-2-4-6-10;1-9-3-5-10(6-4-9)12-8-2-7-11-12;;/h4-11H,1-3H3;2-10H,1H3;3-10H,1-2H3;2-9H,14H2,1H3;2-10H,1H3;4-9H,3H2,1-2H3;2-10H,1H3;2-9H,1H3;2-5H,6-9H2,1H3;2*2-8H,1H3;2*1H4.

What are the key properties of N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene?

N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene has a molecular weight of 2038.91 g/mol, XLogP of 37.97, 15 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-dimethyl-4-(4-methylphenyl)aniline;2-(4-ethylphenyl)-5-methylthiophene;methane;1-methyl-2-(4-methylphenyl)benzene;1-methyl-4-phenoxybenzene;4-(4-methylphenyl)aniline;1-methyl-3-phenylbenzene;4-(4-methylphenyl)morpholine;(4-methylphenyl)-phenylmethanone;1-(4-methylphenyl)pyrazole;2-methyl-5-phenylpyridine;2-methyl-5-phenylthiophene is sourced from PubChem (CID 159989866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).