2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan

C13H16O — CID 142510186

IUPAC2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan
SMILESC=Cc1oc(C)c(/C=C\C)c1/C=C\C
InChIInChI=1S/C13H16O/c1-5-8-11-10(4)14-13(7-3)12(11)9-6-2/h5-9H,3H2,1-2,4H3/b8-5-,9-6-
InChIKeyPWUXMEHUWXXOGV-VVRUXRSYSA-N
MW188.27 g/mol
LogP4.30
Rot. Bonds3

About 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan

2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan (PubChem CID 142510186) has the molecular formula C13H16O and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan.

Molecular Properties

Compound Name2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan
PubChem CID142510186
Molecular FormulaC13H16O
Molecular Weight188.27 g/mol
Exact Mass188.12
IUPAC Name2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan
SMILESC=Cc1oc(C)c(/C=C\C)c1/C=C\C
InChIInChI=1S/C13H16O/c1-5-8-11-10(4)14-13(7-3)12(11)9-6-2/h5-9H,3H2,1-2,4H3/b8-5-,9-6-
InChIKeyPWUXMEHUWXXOGV-VVRUXRSYSA-N
XLogP4.30
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethenyl-4-methyl-3-[(Z)-prop-1-enyl]-1-benzofuran
CID 130336629
1,5-bis(ethenyl)-2-methyl-3,4,6-tris[(Z)-prop-1-enyl]benzene
CID 143846029
ethane;5-ethenyl-4-[(Z)-prop-1-enyl]-1,2-oxazol-3-one
CID 143109190
2-ethenyl-5-propan-2-yl-3-[(Z)-prop-1-enyl]-1-benzofuran
CID 144612981
[2-ethenyl-3-[(Z)-prop-1-enyl]-1-benzofuran-7-yl]boronic acid
CID 144640440
3-ethenyl-2,4,5-trimethylfuran
CID 167164400
ethane;4-ethenyl-2-methyl-5-[(Z)-prop-1-enyl]-1,3-oxazole
CID 142166033
2-[2-ethenyl-3-[(Z)-prop-1-enyl]-1-benzofuran-5-yl]-6-methylpyridine
CID 166654735
5-[2-ethenyl-1-[(Z)-prop-1-enyl]-[1]benzofuro[3,2-e][1]benzofuran-9-yl]-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 167256599
(1E,4Z)-1-[4-ethenyl-3-methyl-5-[(Z)-prop-1-enyl]furan-2-yl]hexa-1,4-diene-2-thiol
CID 146671697
2,3-bis(ethenyl)-4-methyl-5-propan-2-ylfuran
CID 170615832
1-ethenyl-2,3,5-trifluoro-4-methyl-6-[(E)-prop-1-enyl]benzene
CID 139403704

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan?
The IUPAC name of 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan (CID 142510186) is 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan.
What is the SMILES notation for 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan?
The canonical SMILES for 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan is C=Cc1oc(C)c(/C=C\C)c1/C=C\C.
What is the InChIKey of 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan?
The InChIKey is PWUXMEHUWXXOGV-VVRUXRSYSA-N. The full InChI is InChI=1S/C13H16O/c1-5-8-11-10(4)14-13(7-3)12(11)9-6-2/h5-9H,3H2,1-2,4H3/b8-5-,9-6-.
What are the key properties of 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan?
2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan has a molecular weight of 188.27 g/mol, XLogP of 4.30, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-5-methyl-3,4-bis[(Z)-prop-1-enyl]furan is sourced from PubChem (CID 142510186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).