ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene

C20H24 — CID 145120170

IUPACethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene
SMILESC=C/C=c1\c(=C)c(C)c(/C=C\C)c2ccccc12.CC
InChIInChI=1S/C18H18.C2H6/c1-5-9-15-13(3)14(4)16(10-6-2)18-12-8-7-11-17(15)18;1-2/h5-12H,1,3H2,2,4H3;1-2H3/b10-6-,15-9+;
InChIKeyJCJUTIBRWMEEQK-DXPUCIBRSA-N
MW264.41 g/mol
LogP4.58
Rot. Bonds2

About ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene

ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene (PubChem CID 145120170) has the molecular formula C20H24 and a molecular weight of 264.41 g/mol. Its IUPAC name is ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene.

Molecular Properties

Compound Nameethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene
PubChem CID145120170
Molecular FormulaC20H24
Molecular Weight264.41 g/mol
Exact Mass264.19
IUPAC Nameethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene
SMILESC=C/C=c1\c(=C)c(C)c(/C=C\C)c2ccccc12.CC
InChIInChI=1S/C18H18.C2H6/c1-5-9-15-13(3)14(4)16(10-6-2)18-12-8-7-11-17(15)18;1-2/h5-12H,1,3H2,2,4H3;1-2H3/b10-6-,15-9+;
InChIKeyJCJUTIBRWMEEQK-DXPUCIBRSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene?
The IUPAC name of ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene (CID 145120170) is ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene.
What is the SMILES notation for ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene?
The canonical SMILES for ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene is C=C/C=c1\c(=C)c(C)c(/C=C\C)c2ccccc12.CC.
What is the InChIKey of ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene?
The InChIKey is JCJUTIBRWMEEQK-DXPUCIBRSA-N. The full InChI is InChI=1S/C18H18.C2H6/c1-5-9-15-13(3)14(4)16(10-6-2)18-12-8-7-11-17(15)18;1-2/h5-12H,1,3H2,2,4H3;1-2H3/b10-6-,15-9+;.
What are the key properties of ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene?
ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene has a molecular weight of 264.41 g/mol, XLogP of 4.58, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(4E)-2-methyl-3-methylidene-1-[(Z)-prop-1-enyl]-4-prop-2-enylidenenaphthalene is sourced from PubChem (CID 145120170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).