1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene

C18H22O — CID 60644477

IUPAC1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene
SMILESCCc1cccc(OCc2ccc(C(C)C)cc2)c1
InChIInChI=1S/C18H22O/c1-4-15-6-5-7-18(12-15)19-13-16-8-10-17(11-9-16)14(2)3/h5-12,14H,4,13H2,1-3H3
InChIKeyAEPQJCGABHDAKE-UHFFFAOYSA-N
MW254.37 g/mol
LogP4.95
Rot. Bonds5

About 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene

1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene (PubChem CID 60644477) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene.

Molecular Properties

Compound Name1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene
PubChem CID60644477
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene
SMILESCCc1cccc(OCc2ccc(C(C)C)cc2)c1
InChIInChI=1S/C18H22O/c1-4-15-6-5-7-18(12-15)19-13-16-8-10-17(11-9-16)14(2)3/h5-12,14H,4,13H2,1-3H3
InChIKeyAEPQJCGABHDAKE-UHFFFAOYSA-N
XLogP4.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-4-[(4-propan-2-ylphenyl)methoxy]benzene
CID 59709478
2-(3-ethylphenoxy)-1-(4-propan-2-ylphenyl)ethanone
CID 43411799
cumene;ethane;1-ethyl-3-methoxybenzene
CID 171630693
1-chloro-4-[(3-ethylphenoxy)methyl]-2-fluorobenzene
CID 107888345
1-[(3-ethylphenoxy)methyl]-3,5-difluorobenzene
CID 105409859
1-bromo-3-[(3-ethylphenoxy)methyl]benzene
CID 60645294
1,3-di(propan-2-yl)benzene;1-ethyl-3-methoxybenzene
CID 178169906
ethane;1-ethyl-3-[(3-fluorophenyl)methoxy]benzene
CID 176690950
3-[(4-propan-2-ylphenyl)methoxy]-N-propylbenzamide
CID 86031288
5-[(3-ethylphenoxy)methyl]-1,2-dihydropyrazol-3-one
CID 56945438
1-ethyl-3-(3-methylbutoxy)benzene
CID 64763822
methyl 2-phenylmethoxy-4-[(4-propan-2-ylphenyl)methoxy]benzoate
CID 10596554

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene?
The IUPAC name of 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene (CID 60644477) is 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene.
What is the SMILES notation for 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene?
The canonical SMILES for 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene is CCc1cccc(OCc2ccc(C(C)C)cc2)c1.
What is the InChIKey of 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene?
The InChIKey is AEPQJCGABHDAKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-4-15-6-5-7-18(12-15)19-13-16-8-10-17(11-9-16)14(2)3/h5-12,14H,4,13H2,1-3H3.
What are the key properties of 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene?
1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene has a molecular weight of 254.37 g/mol, XLogP of 4.95, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[(4-propan-2-ylphenyl)methoxy]benzene is sourced from PubChem (CID 60644477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).