4-pent-2-en-2-yldibenzofuran

C17H16O — CID 123566469

IUPAC4-pent-2-en-2-yldibenzofuran
SMILESCCC=C(C)c1cccc2c1oc1ccccc12
InChIInChI=1S/C17H16O/c1-3-7-12(2)13-9-6-10-15-14-8-4-5-11-16(14)18-17(13)15/h4-11H,3H2,1-2H3
InChIKeyRSRBMPXEKIIFOI-UHFFFAOYSA-N
MW236.31 g/mol
LogP5.40
Rot. Bonds2

About 4-pent-2-en-2-yldibenzofuran

4-pent-2-en-2-yldibenzofuran (PubChem CID 123566469) has the molecular formula C17H16O and a molecular weight of 236.31 g/mol. Its IUPAC name is 4-pent-2-en-2-yldibenzofuran.

Molecular Properties

Compound Name4-pent-2-en-2-yldibenzofuran
PubChem CID123566469
Molecular FormulaC17H16O
Molecular Weight236.31 g/mol
Exact Mass236.12
IUPAC Name4-pent-2-en-2-yldibenzofuran
SMILESCCC=C(C)c1cccc2c1oc1ccccc12
InChIInChI=1S/C17H16O/c1-3-7-12(2)13-9-6-10-15-14-8-4-5-11-16(14)18-17(13)15/h4-11H,3H2,1-2H3
InChIKeyRSRBMPXEKIIFOI-UHFFFAOYSA-N
XLogP5.40
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.31
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-pent-2-en-2-yldibenzofuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-dibenzofuran-4-ylethanone
CID 15691981
N-[(1Z,3Z)-3-methylhexa-1,3-dienyl]dibenzofuran-4-amine
CID 145212273
3-ethenyl-2-[(Z)-pent-2-en-2-yl]-1-benzofuran
CID 143232287
4-but-1-enyldibenzofuran
CID 154131929
4-[1-(2-methylphenyl)ethenyl]dibenzofuran
CID 144645412
dibenzofuran;ethanol
CID 174821059
dibenzofuran-4-carboximidamide
CID 142482098
2-[(E)-pent-2-en-2-yl]benzoic acid
CID 168936583
4-[(2S)-butan-2-yl]dibenzofuran
CID 142504734
(Z)-4-dibenzofuran-4-yl-N-methyl-2-phenylbut-2-en-1-imine
CID 145299478
N-dibenzofuran-4-ylpropanamide
CID 138533625
dibenzofuran-4-yl(trimethyl)silane
CID 10752569

Frequently Asked Questions

What is the IUPAC name of 4-pent-2-en-2-yldibenzofuran?
The IUPAC name of 4-pent-2-en-2-yldibenzofuran (CID 123566469) is 4-pent-2-en-2-yldibenzofuran.
What is the SMILES notation for 4-pent-2-en-2-yldibenzofuran?
The canonical SMILES for 4-pent-2-en-2-yldibenzofuran is CCC=C(C)c1cccc2c1oc1ccccc12.
What is the InChIKey of 4-pent-2-en-2-yldibenzofuran?
The InChIKey is RSRBMPXEKIIFOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O/c1-3-7-12(2)13-9-6-10-15-14-8-4-5-11-16(14)18-17(13)15/h4-11H,3H2,1-2H3.
What are the key properties of 4-pent-2-en-2-yldibenzofuran?
4-pent-2-en-2-yldibenzofuran has a molecular weight of 236.31 g/mol, XLogP of 5.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pent-2-en-2-yldibenzofuran is sourced from PubChem (CID 123566469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).