5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine

C18H23N — CID 163857972

IUPAC5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine
SMILESCCc1cnc(-c2ccc(CC(C)C)cc2)cc1C
InChIInChI=1S/C18H23N/c1-5-16-12-19-18(11-14(16)4)17-8-6-15(7-9-17)10-13(2)3/h6-9,11-13H,5,10H2,1-4H3
InChIKeyOZZRRJXRGCSNIT-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.82
Rot. Bonds4

About 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine

5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine (PubChem CID 163857972) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine.

Molecular Properties

Compound Name5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine
PubChem CID163857972
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC Name5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine
SMILESCCc1cnc(-c2ccc(CC(C)C)cc2)cc1C
InChIInChI=1S/C18H23N/c1-5-16-12-19-18(11-14(16)4)17-8-6-15(7-9-17)10-13(2)3/h6-9,11-13H,5,10H2,1-4H3
InChIKeyOZZRRJXRGCSNIT-UHFFFAOYSA-N
XLogP4.82
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-methylphenyl)-5-(2-methylpropyl)pyridine
CID 71106004
5-ethyl-4-methyl-2-(2-methyl-4-pyridinyl)pyridine
CID 123346906
4-ethyl-2-(2-methylphenyl)-5-(2-methylpropyl)pyridine
CID 129021064
1-N,3-N,5-N-tris[6-[4-(2-methylpropyl)phenyl]-3-pyridinyl]benzene-1,3,5-tricarboxamide
CID 126638758
5-methyl-3-[4-(2-methylpropyl)phenyl]-1,2-oxazole
CID 143746738
5-benzyl-4-methyl-2-phenylpyridine
CID 162710232
[2-methyl-4-[4-(2-methylpropyl)phenyl]phenyl]methanol
CID 172652299
3-[3-[4-(2-methylpropyl)phenyl]phenyl]isoquinoline
CID 170539197
7-(2-methylpropyl)-3-phenylisoquinoline
CID 170528428
5-(2,2-dimethylpropyl)-4-methyl-2-phenylpyridine
CID 129022095
2,5-bis(4-ethylphenyl)pyridine
CID 101383412
5-ethyl-2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methylpyridine
CID 164948177

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine?
The IUPAC name of 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine (CID 163857972) is 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine.
What is the SMILES notation for 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine?
The canonical SMILES for 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine is CCc1cnc(-c2ccc(CC(C)C)cc2)cc1C.
What is the InChIKey of 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine?
The InChIKey is OZZRRJXRGCSNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-5-16-12-19-18(11-14(16)4)17-8-6-15(7-9-17)10-13(2)3/h6-9,11-13H,5,10H2,1-4H3.
What are the key properties of 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine?
5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine has a molecular weight of 253.39 g/mol, XLogP of 4.82, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyl-2-[4-(2-methylpropyl)phenyl]pyridine is sourced from PubChem (CID 163857972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).