ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene

C14H24O — CID 171819163

IUPACethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene
SMILESC=CC1=C(/C=C\C)C(C)C(OC)C1.CC
InChIInChI=1S/C12H18O.C2H6/c1-5-7-11-9(3)12(13-4)8-10(11)6-2;1-2/h5-7,9,12H,2,8H2,1,3-4H3;1-2H3/b7-5-;
InChIKeyUFHSYJOHFHJDKR-YJOCEBFMSA-N
MW208.34 g/mol
LogP4.13
Rot. Bonds3

About ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene

ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene (PubChem CID 171819163) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene.

Molecular Properties

Compound Nameethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene
PubChem CID171819163
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Nameethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene
SMILESC=CC1=C(/C=C\C)C(C)C(OC)C1.CC
InChIInChI=1S/C12H18O.C2H6/c1-5-7-11-9(3)12(13-4)8-10(11)6-2;1-2/h5-7,9,12H,2,8H2,1,3-4H3;1-2H3/b7-5-;
InChIKeyUFHSYJOHFHJDKR-YJOCEBFMSA-N
XLogP4.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethenyl-4-[(Z)-prop-1-enyl]cyclopent-3-en-1-ol
CID 143180864
ethane;5-ethenyl-2-methyl-6-[(Z)-prop-1-enyl]-1,2,3,4-tetrahydropyridine
CID 143453691
ethane;1,2,4-tris(ethenyl)-3-[(Z)-prop-1-enyl]cyclopenta-1,3-diene
CID 142480313
ethane;3-ethenyl-4-prop-2-enoxy-2-[(Z)-prop-1-enyl]cyclopent-2-en-1-amine
CID 143411990
ethane;3-ethenyl-1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrole
CID 143141932
(3R)-2-ethenyl-3-methyl-1-[(Z)-prop-1-enyl]cyclohexene
CID 145347236
ethane;1-methoxy-2-methylcyclopentane
CID 142110191
[3,4-bis(ethenyl)-2,5-bis[(Z)-prop-1-enyl]cyclopenta-2,4-dien-1-yl]methanol;ethane
CID 163301264
2-ethenyl-4-propan-2-yl-1-[(Z)-prop-1-enyl]cyclohexene
CID 157035791
trans-(1S,2S)-1-methoxy-2-methylcyclopropane
CID 176834458
4,5-bis(ethenyl)-2-methyl-2,3-dihydrofuran;ethane
CID 144691925
ethane;4-ethenyl-2-methyl-5-[(Z)-prop-1-enyl]-3H-pyrrole
CID 142986985

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene?
The IUPAC name of ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene (CID 171819163) is ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene.
What is the SMILES notation for ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene?
The canonical SMILES for ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene is C=CC1=C(/C=C\C)C(C)C(OC)C1.CC.
What is the InChIKey of ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene?
The InChIKey is UFHSYJOHFHJDKR-YJOCEBFMSA-N. The full InChI is InChI=1S/C12H18O.C2H6/c1-5-7-11-9(3)12(13-4)8-10(11)6-2;1-2/h5-7,9,12H,2,8H2,1,3-4H3;1-2H3/b7-5-;.
What are the key properties of ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene?
ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene has a molecular weight of 208.34 g/mol, XLogP of 4.13, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethenyl-4-methoxy-3-methyl-2-[(Z)-prop-1-enyl]cyclopentene is sourced from PubChem (CID 171819163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).