1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene

C19H24O2 — CID 142493435

IUPAC1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene
SMILESCCc1ccc(COc2ccc(COC(C)C)cc2)cc1
InChIInChI=1S/C19H24O2/c1-4-16-5-7-17(8-6-16)14-21-19-11-9-18(10-12-19)13-20-15(2)3/h5-12,15H,4,13-14H2,1-3H3
InChIKeyYFBZCXJNQYKWHE-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.75
Rot. Bonds7

About 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene

1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene (PubChem CID 142493435) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene.

Molecular Properties

Compound Name1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene
PubChem CID142493435
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene
SMILESCCc1ccc(COc2ccc(COC(C)C)cc2)cc1
InChIInChI=1S/C19H24O2/c1-4-16-5-7-17(8-6-16)14-21-19-11-9-18(10-12-19)13-20-15(2)3/h5-12,15H,4,13-14H2,1-3H3
InChIKeyYFBZCXJNQYKWHE-UHFFFAOYSA-N
XLogP4.75
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-4-[(4-propan-2-ylphenyl)methoxy]benzene
CID 59709478
2-[4-[(4-ethylphenoxy)methyl]phenyl]propan-1-amine
CID 105350533
1-ethyl-4-(2-propan-2-yloxyethoxy)benzene
CID 60643723
(1R)-1-[4-[(4-ethylphenyl)methoxy]phenyl]ethanamine
CID 63367548
1-butan-2-yl-4-[(4-ethylphenyl)methoxy]benzene
CID 107669037
2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol
CID 103844538
1-ethyl-4-[[4-(trifluoromethoxy)phenyl]methoxy]benzene
CID 64765106
1-(propan-2-yloxymethyl)-4-(trifluoromethoxy)benzene
CID 91726745
1-ethyl-4-[(4-pentylphenyl)methoxy]benzene
CID 142992218
4-[(4-ethylphenoxy)methyl]benzoic acid
CID 585022
1-phenylmethoxy-4-(2-propan-2-yloxyethoxy)benzene
CID 58914302
1-(methoxymethyl)-4-(propan-2-yloxymethyl)benzene
CID 70670788

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene?
The IUPAC name of 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene (CID 142493435) is 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene.
What is the SMILES notation for 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene?
The canonical SMILES for 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene is CCc1ccc(COc2ccc(COC(C)C)cc2)cc1.
What is the InChIKey of 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene?
The InChIKey is YFBZCXJNQYKWHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c1-4-16-5-7-17(8-6-16)14-21-19-11-9-18(10-12-19)13-20-15(2)3/h5-12,15H,4,13-14H2,1-3H3.
What are the key properties of 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene?
1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene has a molecular weight of 284.40 g/mol, XLogP of 4.75, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[[4-(propan-2-yloxymethyl)phenoxy]methyl]benzene is sourced from PubChem (CID 142493435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).