2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine

C18H23N — CID 169160403

IUPAC2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine
SMILESCCCc1cccc(CCc2ccc(C)cc2C)n1
InChIInChI=1S/C18H23N/c1-4-6-17-7-5-8-18(19-17)12-11-16-10-9-14(2)13-15(16)3/h5,7-10,13H,4,6,11-12H2,1-3H3
InChIKeyLFMAUBQGEVILIP-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.44
Rot. Bonds5

About 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine

2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine (PubChem CID 169160403) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine.

Molecular Properties

Compound Name2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine
PubChem CID169160403
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC Name2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine
SMILESCCCc1cccc(CCc2ccc(C)cc2C)n1
InChIInChI=1S/C18H23N/c1-4-6-17-7-5-8-18(19-17)12-11-16-10-9-14(2)13-15(16)3/h5,7-10,13H,4,6,11-12H2,1-3H3
InChIKeyLFMAUBQGEVILIP-UHFFFAOYSA-N
XLogP4.44
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-dimethyl-1-[2-(3-methylphenyl)ethyl]benzene
CID 165145096
but-1-ene;2,4-dimethyl-1-propylbenzene;ethane
CID 165130204
2-(2,4-dimethylphenyl)-N-ethylethanamine
CID 62801673
2,4-dimethyl-1-(2-phenylethyl)benzene;gold
CID 173364905
4-methyl-2,6-dipropylpyridine
CID 13400495
(2,4-dimethylphenyl)methanamine;propane
CID 143780972
1-ethyl-2,4-dimethylbenzene;propane
CID 143347602
1-[2-(3-but-2-en-2-ylphenyl)ethyl]-2,4-dimethylbenzene
CID 153358848
2,6-dipentylpyridine
CID 58097448
N-[2-(2,4-dimethylphenyl)ethyl]ethanesulfonamide
CID 47429985
2-[(2,4-dimethylphenyl)methyl]-1-ethyl-3-[(6-methyl-2-pyridinyl)methyl]guanidine
CID 111938287
1-[[6-(dimethylamino)-2-pyridinyl]methyl]-2-[(2,4-dimethylphenyl)methyl]-3-ethylguanidine;hydroiodide
CID 109407085

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine?
The IUPAC name of 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine (CID 169160403) is 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine.
What is the SMILES notation for 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine?
The canonical SMILES for 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine is CCCc1cccc(CCc2ccc(C)cc2C)n1.
What is the InChIKey of 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine?
The InChIKey is LFMAUBQGEVILIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-4-6-17-7-5-8-18(19-17)12-11-16-10-9-14(2)13-15(16)3/h5,7-10,13H,4,6,11-12H2,1-3H3.
What are the key properties of 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine?
2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine has a molecular weight of 253.39 g/mol, XLogP of 4.44, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,4-dimethylphenyl)ethyl]-6-propylpyridine is sourced from PubChem (CID 169160403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).