5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine

C21H21N — CID 140847511

IUPAC5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine
SMILESCCc1cnc(-c2ccc(-c3ccccc3)c(C)c2)c(C)c1
InChIInChI=1S/C21H21N/c1-4-17-12-16(3)21(22-14-17)19-10-11-20(15(2)13-19)18-8-6-5-7-9-18/h5-14H,4H2,1-3H3
InChIKeyKULVBGIRJFPWPH-UHFFFAOYSA-N
MW287.41 g/mol
LogP5.59
Rot. Bonds3

About 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine

5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine (PubChem CID 140847511) has the molecular formula C21H21N and a molecular weight of 287.41 g/mol. Its IUPAC name is 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine.

Molecular Properties

Compound Name5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine
PubChem CID140847511
Molecular FormulaC21H21N
Molecular Weight287.41 g/mol
Exact Mass287.17
IUPAC Name5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine
SMILESCCc1cnc(-c2ccc(-c3ccccc3)c(C)c2)c(C)c1
InChIInChI=1S/C21H21N/c1-4-17-12-16(3)21(22-14-17)19-10-11-20(15(2)13-19)18-8-6-5-7-9-18/h5-14H,4H2,1-3H3
InChIKeyKULVBGIRJFPWPH-UHFFFAOYSA-N
XLogP5.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.41
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,5-dimethyl-2-(3-methyl-4-phenylphenyl)pyridine
CID 140847672
2-methyl-1-phenyl-4-(2-phenylphenyl)benzene
CID 59171665
3-(5-ethyl-3-methyl-2-pyridinyl)benzamide
CID 143772061
3-methyl-2-(3-methyl-4-pyridin-3-ylphenyl)-5-pyridin-3-ylpyridine
CID 102045011
[4-(4-ethylphenyl)-3-methylphenyl]methanamine
CID 66481033
5-fluoro-3-methyl-2-phenylpyridine
CID 46314858
1-iodo-2,3-dimethyl-4-(3-methyl-4-phenylphenyl)benzene
CID 170131212
trimethyl-[4-methyl-6-(3-methyl-4-phenylphenyl)-3-pyridinyl]silane
CID 166574256
1-[3-methyl-4-[2-methyl-4-[3-methyl-4-[2-methyl-4-(2-phenylphenyl)phenyl]phenyl]phenyl]phenyl]-3,5-diphenylbenzene
CID 58881209
2-(3-methyl-4-phenylphenyl)acetic acid
CID 18793942
trimethyl-[4-(3-methyl-4-phenylphenyl)quinazolin-7-yl]germane
CID 159098075
2-ethyl-4-methylazulene
CID 154376639

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine?
The IUPAC name of 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine (CID 140847511) is 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine.
What is the SMILES notation for 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine?
The canonical SMILES for 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine is CCc1cnc(-c2ccc(-c3ccccc3)c(C)c2)c(C)c1.
What is the InChIKey of 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine?
The InChIKey is KULVBGIRJFPWPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N/c1-4-17-12-16(3)21(22-14-17)19-10-11-20(15(2)13-19)18-8-6-5-7-9-18/h5-14H,4H2,1-3H3.
What are the key properties of 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine?
5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine has a molecular weight of 287.41 g/mol, XLogP of 5.59, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-2-(3-methyl-4-phenylphenyl)pyridine is sourced from PubChem (CID 140847511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).