1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene

C15H24O — CID 70932281

IUPAC1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene
SMILESCCc1cc(CC(C)C)cc(OC(C)C)c1
InChIInChI=1S/C15H24O/c1-6-13-8-14(7-11(2)3)10-15(9-13)16-12(4)5/h8-12H,6-7H2,1-5H3
InChIKeyFBZSCJFKHQDOHU-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.23
Rot. Bonds5

About 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene

1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene (PubChem CID 70932281) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene.

Molecular Properties

Compound Name1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene
PubChem CID70932281
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene
SMILESCCc1cc(CC(C)C)cc(OC(C)C)c1
InChIInChI=1S/C15H24O/c1-6-13-8-14(7-11(2)3)10-15(9-13)16-12(4)5/h8-12H,6-7H2,1-5H3
InChIKeyFBZSCJFKHQDOHU-UHFFFAOYSA-N
XLogP4.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-3-methoxy-5-(2-methylpropyl)benzene
CID 155459307
3-ethyl-5-propan-2-yloxybenzamide
CID 71048875
1-(3-ethyl-5-propan-2-yloxyphenyl)prop-2-yn-1-one
CID 89224074
1,3-diethoxy-5-(2-methylpropyl)-2-propan-2-yloxybenzene
CID 135280827
1-(3,5-diethylphenyl)propan-2-amine
CID 89151749
3-(3-ethylphenoxy)-5-propan-2-yloxyaniline
CID 80748281
ethane;1-ethyl-3-(2-methylpropyl)benzene;molecular hydrogen
CID 142978471
1-ethoxy-3-(3-methylbutoxymethyl)-5-(2-methylpropyl)benzene
CID 170133616
1-ethyl-4-(2-methylpropyl)benzene;methane;propane
CID 154659572
lithium;hydride;1,3,5-triethylbenzene
CID 174873379
(4-ethylphenyl)-(4-propan-2-yloxyphenyl)methanamine
CID 43120931
(3,5-diethylphenyl) methyl carbonate
CID 174729067

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene?
The IUPAC name of 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene (CID 70932281) is 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene.
What is the SMILES notation for 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene?
The canonical SMILES for 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene is CCc1cc(CC(C)C)cc(OC(C)C)c1.
What is the InChIKey of 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene?
The InChIKey is FBZSCJFKHQDOHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-6-13-8-14(7-11(2)3)10-15(9-13)16-12(4)5/h8-12H,6-7H2,1-5H3.
What are the key properties of 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene?
1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene has a molecular weight of 220.36 g/mol, XLogP of 4.23, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2-methylpropyl)-5-propan-2-yloxybenzene is sourced from PubChem (CID 70932281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).