ethene;2-methylfuran

C7H10O — CID 67469652

IUPACethene;2-methylfuran
SMILESC=C.Cc1ccco1
InChIInChI=1S/C5H6O.C2H4/c1-5-3-2-4-6-5;1-2/h2-4H,1H3;1-2H2
InChIKeyLIHHOUUATIBSNR-UHFFFAOYSA-N
MW110.16 g/mol
LogP2.39
Rot. Bonds

About ethene;2-methylfuran

ethene;2-methylfuran (PubChem CID 67469652) has the molecular formula C7H10O and a molecular weight of 110.16 g/mol. Its IUPAC name is ethene;2-methylfuran.

Molecular Properties

Compound Nameethene;2-methylfuran
PubChem CID67469652
Molecular FormulaC7H10O
Molecular Weight110.16 g/mol
Exact Mass110.07
IUPAC Nameethene;2-methylfuran
SMILESC=C.Cc1ccco1
InChIInChI=1S/C5H6O.C2H4/c1-5-3-2-4-6-5;1-2/h2-4H,1H3;1-2H2
InChIKeyLIHHOUUATIBSNR-UHFFFAOYSA-N
XLogP2.39
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 52.39
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

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2-methylfuran;propan-1-ol
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CID 159728108
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CID 143298157
ethane;2-(furan-2-yl)furan
CID 161366084
2,3-bis(furan-2-yl)-6,7-dimethylquinoxaline
CID 5125983
5-[di(thiophen-3-yl)methylidene]-2H-furan-2-ol;2-methylfuran
CID 157361878
furan-2-yl(methyl)phosphane
CID 146551683

Frequently Asked Questions

What is the IUPAC name of ethene;2-methylfuran?
The IUPAC name of ethene;2-methylfuran (CID 67469652) is ethene;2-methylfuran.
What is the SMILES notation for ethene;2-methylfuran?
The canonical SMILES for ethene;2-methylfuran is C=C.Cc1ccco1.
What is the InChIKey of ethene;2-methylfuran?
The InChIKey is LIHHOUUATIBSNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6O.C2H4/c1-5-3-2-4-6-5;1-2/h2-4H,1H3;1-2H2.
What are the key properties of ethene;2-methylfuran?
ethene;2-methylfuran has a molecular weight of 110.16 g/mol, XLogP of 2.39, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;2-methylfuran is sourced from PubChem (CID 67469652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).