2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine

C23H25N — CID 170364620

IUPAC2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine
SMILESCc1cc(C)c(-c2cc(C(C)C)c(C)cn2)cc1-c1ccccc1
InChIInChI=1S/C23H25N/c1-15(2)20-13-23(24-14-18(20)5)22-12-21(16(3)11-17(22)4)19-9-7-6-8-10-19/h6-15H,1-5H3
InChIKeyIPCOOPXWOCKPBW-UHFFFAOYSA-N
MW315.46 g/mol
LogP6.46
Rot. Bonds3

About 2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine

2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine (PubChem CID 170364620) has the molecular formula C23H25N and a molecular weight of 315.46 g/mol. Its IUPAC name is 2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine.

Molecular Properties

Compound Name2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine
PubChem CID170364620
Molecular FormulaC23H25N
Molecular Weight315.46 g/mol
Exact Mass315.20
IUPAC Name2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine
SMILESCc1cc(C)c(-c2cc(C(C)C)c(C)cn2)cc1-c1ccccc1
InChIInChI=1S/C23H25N/c1-15(2)20-13-23(24-14-18(20)5)22-12-21(16(3)11-17(22)4)19-9-7-6-8-10-19/h6-15H,1-5H3
InChIKeyIPCOOPXWOCKPBW-UHFFFAOYSA-N
XLogP6.46
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.46
LogP ≤ 56.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine?
The IUPAC name of 2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine (CID 170364620) is 2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine.
What is the SMILES notation for 2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine?
The canonical SMILES for 2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine is Cc1cc(C)c(-c2cc(C(C)C)c(C)cn2)cc1-c1ccccc1.
What is the InChIKey of 2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine?
The InChIKey is IPCOOPXWOCKPBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N/c1-15(2)20-13-23(24-14-18(20)5)22-12-21(16(3)11-17(22)4)19-9-7-6-8-10-19/h6-15H,1-5H3.
What are the key properties of 2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine?
2-(2,4-dimethyl-5-phenylphenyl)-5-methyl-4-propan-2-ylpyridine has a molecular weight of 315.46 g/mol, XLogP of 6.46, 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-methyl-4-propan-2-ylpyridine is sourced from PubChem (CID 170364620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).