(4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene

C18H26 — CID 145141144

IUPAC(4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene
SMILESC=CC.C=CC1=C(C)C(=C)/C(=C\C=C/C)C1(C)C
InChIInChI=1S/C15H20.C3H6/c1-7-9-10-14-12(4)11(3)13(8-2)15(14,5)6;1-3-2/h7-10H,2,4H2,1,3,5-6H3;3H,1H2,2H3/b9-7-,14-10+;
InChIKeyHGZCHCLTKZGSGN-VXVPFTHISA-N
MW242.41 g/mol
LogP5.78
Rot. Bonds2

About (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene

(4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene (PubChem CID 145141144) has the molecular formula C18H26 and a molecular weight of 242.41 g/mol. Its IUPAC name is (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene.

Molecular Properties

Compound Name(4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene
PubChem CID145141144
Molecular FormulaC18H26
Molecular Weight242.41 g/mol
Exact Mass242.20
IUPAC Name(4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene
SMILESC=CC.C=CC1=C(C)C(=C)/C(=C\C=C/C)C1(C)C
InChIInChI=1S/C15H20.C3H6/c1-7-9-10-14-12(4)11(3)13(8-2)15(14,5)6;1-3-2/h7-10H,2,4H2,1,3,5-6H3;3H,1H2,2H3/b9-7-,14-10+;
InChIKeyHGZCHCLTKZGSGN-VXVPFTHISA-N
XLogP5.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.41
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethene;(2Z,5Z)-2-ethylidene-1,1-dimethyl-3,4-dimethylidene-5-prop-2-enylidenecyclopentane
CID 144919613
(5Z,6E)-3-ethenyl-5-ethylidene-4,4-dimethyl-2-[(Z)-prop-1-enyl]-6-prop-2-enylidene-1H-pyridine
CID 146245988
N-[(E,1Z)-1-[3-[(1Z)-buta-1,3-dienyl]-2,2,4-trimethyl-5-methylidenecyclopent-3-en-1-ylidene]but-2-en-2-yl]-4-[(3E)-penta-1,3-dien-3-yl]aniline
CID 145159728
2-ethenyl-1,1,3-trimethyl-5,6-dihydroindene
CID 144766027
2-but-2-enylidene-4-methyl-3-methylidenefuran
CID 123322434
(4E)-4-[(Z)-but-2-enylidene]-3,5-dimethylidenepyrrolidin-2-one
CID 155313173
(4Z)-4-[(Z)-but-2-enylidene]-3,5,5-trimethylcyclohex-2-en-1-one
CID 6437349
(5E)-5-[(Z)-but-2-enylidene]-1,2,3-tris(ethenyl)-6-methylidene-4-[(Z)-prop-1-enyl]cyclohexa-1,3-diene
CID 174326302
(5E)-5-[(Z)-but-2-enylidene]-2-ethenyl-6-methylidene-3-[(Z)-prop-1-enyl]cyclohex-2-ene-1,4-dione;ethane
CID 144875528
1-[(1Z)-buta-1,3-dienyl]-2,3-dimethyl-5-methylidene-4-[(Z)-prop-1-enyl]cyclopenta-1,3-diene
CID 144789889
but-2-ene;bis(prop-1-ene)
CID 157334183
(3E)-3-[(E)-but-2-enylidene]-6-(2-deuterioethenyl)-1,1,4,5,8,8-hexamethyl-7,8a-dihydro-2H-naphthalene
CID 59880402

Frequently Asked Questions

What is the IUPAC name of (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene?
The IUPAC name of (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene (CID 145141144) is (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene.
What is the SMILES notation for (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene?
The canonical SMILES for (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene is C=CC.C=CC1=C(C)C(=C)/C(=C\C=C/C)C1(C)C.
What is the InChIKey of (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene?
The InChIKey is HGZCHCLTKZGSGN-VXVPFTHISA-N. The full InChI is InChI=1S/C15H20.C3H6/c1-7-9-10-14-12(4)11(3)13(8-2)15(14,5)6;1-3-2/h7-10H,2,4H2,1,3,5-6H3;3H,1H2,2H3/b9-7-,14-10+;.
What are the key properties of (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene?
(4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene has a molecular weight of 242.41 g/mol, XLogP of 5.78, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-[(Z)-but-2-enylidene]-2-ethenyl-1,3,3-trimethyl-5-methylidenecyclopentene;prop-1-ene is sourced from PubChem (CID 145141144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).