5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene

C14H20 — CID 143194650

IUPAC5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene
SMILESC/C=C(\C=C/CC)CCC1C=CC=C1
InChIInChI=1S/C14H20/c1-3-5-8-13(4-2)11-12-14-9-6-7-10-14/h4-10,14H,3,11-12H2,1-2H3/b8-5-,13-4+
InChIKeyMRRODYFEFREYMK-RPMRFSCESA-N
MW188.31 g/mol
LogP4.42
Rot. Bonds5

About 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene

5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene (PubChem CID 143194650) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene.

Molecular Properties

Compound Name5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene
PubChem CID143194650
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene
SMILESC/C=C(\C=C/CC)CCC1C=CC=C1
InChIInChI=1S/C14H20/c1-3-5-8-13(4-2)11-12-14-9-6-7-10-14/h4-10,14H,3,11-12H2,1-2H3/b8-5-,13-4+
InChIKeyMRRODYFEFREYMK-RPMRFSCESA-N
XLogP4.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene?
The IUPAC name of 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene (CID 143194650) is 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene.
What is the SMILES notation for 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene?
The canonical SMILES for 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene is C/C=C(\C=C/CC)CCC1C=CC=C1.
What is the InChIKey of 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene?
The InChIKey is MRRODYFEFREYMK-RPMRFSCESA-N. The full InChI is InChI=1S/C14H20/c1-3-5-8-13(4-2)11-12-14-9-6-7-10-14/h4-10,14H,3,11-12H2,1-2H3/b8-5-,13-4+.
What are the key properties of 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene?
5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene has a molecular weight of 188.31 g/mol, XLogP of 4.42, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z,3Z)-3-ethylidenehept-4-enyl]cyclopenta-1,3-diene is sourced from PubChem (CID 143194650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).