1-cyclopenta-2,4-dien-1-ylpentoxybenzene

C16H20O — CID 11986274

IUPAC1-cyclopenta-2,4-dien-1-ylpentoxybenzene
SMILESCCCCC(Oc1ccccc1)C1C=CC=C1
InChIInChI=1S/C16H20O/c1-2-3-13-16(14-9-7-8-10-14)17-15-11-5-4-6-12-15/h4-12,14,16H,2-3,13H2,1H3
InChIKeyDKCMIULKIXUEBK-UHFFFAOYSA-N
MW228.34 g/mol
LogP4.37
Rot. Bonds6

About 1-cyclopenta-2,4-dien-1-ylpentoxybenzene

1-cyclopenta-2,4-dien-1-ylpentoxybenzene (PubChem CID 11986274) has the molecular formula C16H20O and a molecular weight of 228.34 g/mol. Its IUPAC name is 1-cyclopenta-2,4-dien-1-ylpentoxybenzene.

Molecular Properties

Compound Name1-cyclopenta-2,4-dien-1-ylpentoxybenzene
PubChem CID11986274
Molecular FormulaC16H20O
Molecular Weight228.34 g/mol
Exact Mass228.15
IUPAC Name1-cyclopenta-2,4-dien-1-ylpentoxybenzene
SMILESCCCCC(Oc1ccccc1)C1C=CC=C1
InChIInChI=1S/C16H20O/c1-2-3-13-16(14-9-7-8-10-14)17-15-11-5-4-6-12-15/h4-12,14,16H,2-3,13H2,1H3
InChIKeyDKCMIULKIXUEBK-UHFFFAOYSA-N
XLogP4.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-phenoxypentan-1-amine
CID 68557687
(1R)-1-phenoxypentane-1-thiol
CID 134536551
tributyl(phenoxy)phosphanium
CID 23415293
undecan-6-yloxybenzene
CID 130316504
tetracosan-8-yloxybenzene
CID 154135377
(2R)-2-phenoxyhexanoic acid
CID 71401043
N,N-diethyl-1-phenoxypentan-1-amine
CID 174914149
dimethyl(1-phenoxypentyl)phosphane;1-phenoxypentylphosphane;hydrobromide;hydrochloride
CID 174049366
decan-2-yloxybenzene
CID 12838331
1-phenoxyhexadecan-1-ol
CID 140512988
4-(4-pentylcyclohexyl)butan-2-yloxybenzene
CID 70114949
2-ethylhexyl-hydroxy-diphenoxyphosphanium;phosphorous acid
CID 137423428

Frequently Asked Questions

What is the IUPAC name of 1-cyclopenta-2,4-dien-1-ylpentoxybenzene?
The IUPAC name of 1-cyclopenta-2,4-dien-1-ylpentoxybenzene (CID 11986274) is 1-cyclopenta-2,4-dien-1-ylpentoxybenzene.
What is the SMILES notation for 1-cyclopenta-2,4-dien-1-ylpentoxybenzene?
The canonical SMILES for 1-cyclopenta-2,4-dien-1-ylpentoxybenzene is CCCCC(Oc1ccccc1)C1C=CC=C1.
What is the InChIKey of 1-cyclopenta-2,4-dien-1-ylpentoxybenzene?
The InChIKey is DKCMIULKIXUEBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20O/c1-2-3-13-16(14-9-7-8-10-14)17-15-11-5-4-6-12-15/h4-12,14,16H,2-3,13H2,1H3.
What are the key properties of 1-cyclopenta-2,4-dien-1-ylpentoxybenzene?
1-cyclopenta-2,4-dien-1-ylpentoxybenzene has a molecular weight of 228.34 g/mol, XLogP of 4.37, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopenta-2,4-dien-1-ylpentoxybenzene is sourced from PubChem (CID 11986274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).