2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene

C14H18O — CID 142896770

IUPAC2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene
SMILESC/C=C\CC.C=C1Cc2ccccc2O1
InChIInChI=1S/C9H8O.C5H10/c1-7-6-8-4-2-3-5-9(8)10-7;1-3-5-4-2/h2-5H,1,6H2;3,5H,4H2,1-2H3/b;5-3-
InChIKeyAOEFEVBHXZMJIW-PJAIOPLOSA-N
MW202.30 g/mol
LogP4.11
Rot. Bonds1

About 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene

2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene (PubChem CID 142896770) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene.

Molecular Properties

Compound Name2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene
PubChem CID142896770
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene
SMILESC/C=C\CC.C=C1Cc2ccccc2O1
InChIInChI=1S/C9H8O.C5H10/c1-7-6-8-4-2-3-5-9(8)10-7;1-3-5-4-2/h2-5H,1,6H2;3,5H,4H2,1-2H3/b;5-3-
InChIKeyAOEFEVBHXZMJIW-PJAIOPLOSA-N
XLogP4.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;2-methylidene-1,3-benzodioxole;2-methylidene-3H-1-benzofuran
CID 159698745
9H-xanthene
CID 7107
2,3-dibromo-4H-chromene
CID 18172585
biphenylene;9H-xanthene
CID 69049558
2,3-diethyl-9H-xanthene
CID 174888406
2-[(E)-but-2-enyl]-2,3-dihydro-1-benzofuran
CID 102067628
1-bromo-9H-xanthene;9H-xanthene
CID 174712211
7-ethenylbicyclo[4.2.0]octa-1,3,5-triene;hexa-1,4-diene
CID 160724552
1,1-dimethyl-2,3-dimethylideneindene;(E)-pent-2-ene
CID 143620330
trimethyl(9H-xanthen-1-yl)silane
CID 175828313
1,2-dimethyl-9H-xanthene
CID 3016191
(3Z)-3-octylidene-4H-chromen-2-one
CID 101133440

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene?
The IUPAC name of 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene (CID 142896770) is 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene.
What is the SMILES notation for 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene?
The canonical SMILES for 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene is C/C=C\CC.C=C1Cc2ccccc2O1.
What is the InChIKey of 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene?
The InChIKey is AOEFEVBHXZMJIW-PJAIOPLOSA-N. The full InChI is InChI=1S/C9H8O.C5H10/c1-7-6-8-4-2-3-5-9(8)10-7;1-3-5-4-2/h2-5H,1,6H2;3,5H,4H2,1-2H3/b;5-3-.
What are the key properties of 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene?
2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene has a molecular weight of 202.30 g/mol, XLogP of 4.11, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-3H-1-benzofuran;(Z)-pent-2-ene is sourced from PubChem (CID 142896770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).