2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene

C19H24O3 — CID 2283991

IUPAC2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene
SMILESCOc1ccccc1OCCOc1cc(C(C)C)ccc1C
InChIInChI=1S/C19H24O3/c1-14(2)16-10-9-15(3)19(13-16)22-12-11-21-18-8-6-5-7-17(18)20-4/h5-10,13-14H,11-12H2,1-4H3
InChIKeyRNNWPTRUTYAQIY-UHFFFAOYSA-N
MW300.40 g/mol
LogP4.58
Rot. Bonds7

About 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene

2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene (PubChem CID 2283991) has the molecular formula C19H24O3 and a molecular weight of 300.40 g/mol. Its IUPAC name is 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene.

Molecular Properties

Compound Name2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene
PubChem CID2283991
Molecular FormulaC19H24O3
Molecular Weight300.40 g/mol
Exact Mass300.17
IUPAC Name2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene
SMILESCOc1ccccc1OCCOc1cc(C(C)C)ccc1C
InChIInChI=1S/C19H24O3/c1-14(2)16-10-9-15(3)19(13-16)22-12-11-21-18-8-6-5-7-17(18)20-4/h5-10,13-14H,11-12H2,1-4H3
InChIKeyRNNWPTRUTYAQIY-UHFFFAOYSA-N
XLogP4.58
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[3-(2-methoxyphenoxy)propoxy]-1-methyl-4-propan-2-ylbenzene
CID 2285673
2-[2-[2-(2-ethoxyphenoxy)ethoxy]ethoxy]-1-methyl-4-propan-2-ylbenzene
CID 2283913
2-(2-methoxyethoxy)-1-methyl-4-propan-2-ylbenzene
CID 112722468
1-methyl-4-propan-2-yl-2-propoxybenzene
CID 78907679
2-[2-(3-methoxypropoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene
CID 103184405
N-methyl-2-(2-methyl-5-propan-2-ylphenoxy)ethanamine
CID 61035897
N-methyl-3-(2-methyl-5-propan-2-ylphenoxy)propan-1-amine
CID 61036143
2-hexoxy-1-methyl-4-propan-2-ylbenzene
CID 81004927
5-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylpentan-1-amine
CID 63497734
2-(2-ethylbutoxy)-1-methyl-4-propan-2-ylbenzene
CID 82924112
2,2-dimethyl-4-(2-methyl-5-propan-2-ylphenoxy)butanimidamide
CID 65251563
1-methyl-2-(phenylmethoxymethoxy)-4-propan-2-ylbenzene
CID 102940832

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene?
The IUPAC name of 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene (CID 2283991) is 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene.
What is the SMILES notation for 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene?
The canonical SMILES for 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene is COc1ccccc1OCCOc1cc(C(C)C)ccc1C.
What is the InChIKey of 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene?
The InChIKey is RNNWPTRUTYAQIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O3/c1-14(2)16-10-9-15(3)19(13-16)22-12-11-21-18-8-6-5-7-17(18)20-4/h5-10,13-14H,11-12H2,1-4H3.
What are the key properties of 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene?
2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene has a molecular weight of 300.40 g/mol, XLogP of 4.58, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyphenoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene is sourced from PubChem (CID 2283991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).