2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine

C25H29N — CID 168721242

IUPAC2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine
SMILESCc1cc(-c2cc(-c3ccccc3)c(C)cc2C)ncc1CC(C)(C)C
InChIInChI=1S/C25H29N/c1-17-13-24(26-16-21(17)15-25(4,5)6)23-14-22(18(2)12-19(23)3)20-10-8-7-9-11-20/h7-14,16H,15H2,1-6H3
InChIKeyVNADHKUNGILMBM-UHFFFAOYSA-N
MW343.51 g/mol
LogP6.93
Rot. Bonds3

About 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine

2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine (PubChem CID 168721242) has the molecular formula C25H29N and a molecular weight of 343.51 g/mol. Its IUPAC name is 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine.

Molecular Properties

Compound Name2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine
PubChem CID168721242
Molecular FormulaC25H29N
Molecular Weight343.51 g/mol
Exact Mass343.23
IUPAC Name2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine
SMILESCc1cc(-c2cc(-c3ccccc3)c(C)cc2C)ncc1CC(C)(C)C
InChIInChI=1S/C25H29N/c1-17-13-24(26-16-21(17)15-25(4,5)6)23-14-22(18(2)12-19(23)3)20-10-8-7-9-11-20/h7-14,16H,15H2,1-6H3
InChIKeyVNADHKUNGILMBM-UHFFFAOYSA-N
XLogP6.93
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.51
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Triprolidine
CID 5282443
(+-)-Dimethindene
CID 21855
Pheniramine
CID 4761
Azatadine
CID 19861
Triprolidine Hydrochloride Anhydrous
CID 5702129
5-Ethyl-2-methylpyridine
CID 7728
4-Phenylpyridine
CID 13651
2-(3-Phenylpropyl)Pyridine
CID 459494
8-Methylquinoline
CID 11910
3-Phenylpyridine
CID 13886
2,3-Diphenylpyrazine
CID 243907
3-Methylisoquinoline
CID 14306

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine?
The IUPAC name of 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine (CID 168721242) is 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine.
What is the SMILES notation for 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine?
The canonical SMILES for 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine is Cc1cc(-c2cc(-c3ccccc3)c(C)cc2C)ncc1CC(C)(C)C.
What is the InChIKey of 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine?
The InChIKey is VNADHKUNGILMBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N/c1-17-13-24(26-16-21(17)15-25(4,5)6)23-14-22(18(2)12-19(23)3)20-10-8-7-9-11-20/h7-14,16H,15H2,1-6H3.
What are the key properties of 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine?
2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine has a molecular weight of 343.51 g/mol, XLogP of 6.93, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethyl-5-phenylphenyl)-5-(2,2-dimethylpropyl)-4-methylpyridine is sourced from PubChem (CID 168721242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).