5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine

C21H27N — CID 3126265

IUPAC5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine
SMILESCCc1ccc(-c2ccc(C3CCC(CC)CC3)cc2)nc1
InChIInChI=1S/C21H27N/c1-3-16-5-8-18(9-6-16)19-10-12-20(13-11-19)21-14-7-17(4-2)15-22-21/h7,10-16,18H,3-6,8-9H2,1-2H3
InChIKeyGXVLUZKLUFKTKI-UHFFFAOYSA-N
MW293.45 g/mol
LogP5.99
Rot. Bonds4

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

5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine (PubChem CID 3126265) has the molecular formula C21H27N and a molecular weight of 293.45 g/mol. Its IUPAC name is 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine.

Molecular Properties

Compound Name5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine
PubChem CID3126265
Molecular FormulaC21H27N
Molecular Weight293.45 g/mol
Exact Mass293.21
IUPAC Name5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine
SMILESCCc1ccc(-c2ccc(C3CCC(CC)CC3)cc2)nc1
InChIInChI=1S/C21H27N/c1-3-16-5-8-18(9-6-16)19-10-12-20(13-11-19)21-14-7-17(4-2)15-22-21/h7,10-16,18H,3-6,8-9H2,1-2H3
InChIKeyGXVLUZKLUFKTKI-UHFFFAOYSA-N
XLogP5.99
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.45
LogP ≤ 55.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-ethyl-2-[4-[(1R,3R,4R)-3-methyl-4-propylcyclohexyl]phenyl]pyridine
CID 7283254
5-(methylsulfanylmethyl)-2-[4-(4-pentylcyclohexyl)phenyl]pyridine
CID 5031623
5-ethyl-2-[4-[2-(4-octylcyclohexyl)ethyl]phenyl]pyridine
CID 18609134
5-hexyl-2-[4-[4-[(4-methoxyphenyl)methoxymethyl]cyclohexyl]phenyl]pyridine
CID 19867253
1-(2,2-difluoropropyl)-4-[4-(4-ethylcyclohexyl)phenyl]benzene
CID 23188567
4-[5-(4-ethylcyclohexyl)-2-pyridinyl]-2-fluorobenzonitrile
CID 139818205
2,5-bis(4-ethylphenyl)pyridine
CID 101383412
2-(4-ethylphenyl)-5-[2-(4-pentylcyclohexyl)ethyl]pyridine
CID 18635627
1-bromo-4-[4-(4-ethylcyclohexyl)phenyl]benzene
CID 170842748
1-ethyl-4-[4-[4-(2-methylbutyl)cyclohexyl]phenyl]benzene
CID 20538959
5-ethoxy-2-[4-[2-(4-ethylcyclohexyl)ethyl]phenyl]pyridine
CID 18609094
1-(4-ethylcyclohexyl)-4-[2-[4-[2-(4-ethylcyclohexyl)ethyl]cyclohexyl]ethyl]benzene
CID 54218031

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine?
The IUPAC name of 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine (CID 3126265) is 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine.
What is the SMILES notation for 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine?
The canonical SMILES for 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine is CCc1ccc(-c2ccc(C3CCC(CC)CC3)cc2)nc1.
What is the InChIKey of 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine?
The InChIKey is GXVLUZKLUFKTKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N/c1-3-16-5-8-18(9-6-16)19-10-12-20(13-11-19)21-14-7-17(4-2)15-22-21/h7,10-16,18H,3-6,8-9H2,1-2H3.
What are the key properties of 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine?
5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine has a molecular weight of 293.45 g/mol, XLogP of 5.99, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-[4-(4-ethylcyclohexyl)phenyl]pyridine is sourced from PubChem (CID 3126265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).