1-(2-methoxyethyl)-4-(2-methylpropyl)benzene

C13H20O — CID 67638248

IUPAC1-(2-methoxyethyl)-4-(2-methylpropyl)benzene
SMILESCOCCc1ccc(CC(C)C)cc1
InChIInChI=1S/C13H20O/c1-11(2)10-13-6-4-12(5-7-13)8-9-14-3/h4-7,11H,8-10H2,1-3H3
InChIKeyBJRJJSYNRPRUBZ-UHFFFAOYSA-N
MW192.30 g/mol
LogP3.07
Rot. Bonds5

About 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene

1-(2-methoxyethyl)-4-(2-methylpropyl)benzene (PubChem CID 67638248) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4-(2-methylpropyl)benzene
PubChem CID67638248
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name1-(2-methoxyethyl)-4-(2-methylpropyl)benzene
SMILESCOCCc1ccc(CC(C)C)cc1
InChIInChI=1S/C13H20O/c1-11(2)10-13-6-4-12(5-7-13)8-9-14-3/h4-7,11H,8-10H2,1-3H3
InChIKeyBJRJJSYNRPRUBZ-UHFFFAOYSA-N
XLogP3.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1-methoxypropan-2-yl)-4-(2-methylpropyl)benzene
CID 134395846
1-(2-methylpropyl)-4-(2-phenylethyl)benzene
CID 56625667
1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene
CID 149288523
1-(1-chloro-2-phenylethyl)-4-(2-methoxyethyl)benzene
CID 61085744
2-methoxy-1-[4-(2-methylpropyl)phenyl]ethanamine
CID 16786344
2-methoxyethylbenzene
CID 19089
N-(2-methoxyethyl)-2-[4-(2-methylpropyl)phenyl]acetamide
CID 78814646
1-tert-butyl-4-(2-methoxyethyl)benzene
CID 67201808
1-[4-(2-methoxyethyl)phenyl]-N,4-dimethylpentan-1-amine
CID 43482360
N-[2-[2-[4-(2-methylpropyl)phenyl]ethoxy]ethyl]propan-1-amine
CID 65303301
1-ethyl-4-[4-(2-methoxyethyl)phenyl]benzene
CID 71122452
1-(2-methylpropyl)-4-pentylbenzene
CID 57045392

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene?
The IUPAC name of 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene (CID 67638248) is 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene.
What is the SMILES notation for 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene?
The canonical SMILES for 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene is COCCc1ccc(CC(C)C)cc1.
What is the InChIKey of 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene?
The InChIKey is BJRJJSYNRPRUBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O/c1-11(2)10-13-6-4-12(5-7-13)8-9-14-3/h4-7,11H,8-10H2,1-3H3.
What are the key properties of 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene?
1-(2-methoxyethyl)-4-(2-methylpropyl)benzene has a molecular weight of 192.30 g/mol, XLogP of 3.07, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4-(2-methylpropyl)benzene is sourced from PubChem (CID 67638248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).