(6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene

C13H16 — CID 143026657

IUPAC(6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene
SMILESC=c1cccc/c1=C/C=C(/C)CC
InChIInChI=1S/C13H16/c1-4-11(2)9-10-13-8-6-5-7-12(13)3/h5-10H,3-4H2,1-2H3/b11-9-,13-10-
InChIKeyZAUJNDQJJRXGNX-VYXXYXFFSA-N
MW172.27 g/mol
LogP2.23
Rot. Bonds2

About (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene

(6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene (PubChem CID 143026657) has the molecular formula C13H16 and a molecular weight of 172.27 g/mol. Its IUPAC name is (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene.

Molecular Properties

Compound Name(6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene
PubChem CID143026657
Molecular FormulaC13H16
Molecular Weight172.27 g/mol
Exact Mass172.13
IUPAC Name(6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene
SMILESC=c1cccc/c1=C/C=C(/C)CC
InChIInChI=1S/C13H16/c1-4-11(2)9-10-13-8-6-5-7-12(13)3/h5-10H,3-4H2,1-2H3/b11-9-,13-10-
InChIKeyZAUJNDQJJRXGNX-VYXXYXFFSA-N
XLogP2.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene?
The IUPAC name of (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene (CID 143026657) is (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene.
What is the SMILES notation for (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene?
The canonical SMILES for (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene is C=c1cccc/c1=C/C=C(/C)CC.
What is the InChIKey of (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene?
The InChIKey is ZAUJNDQJJRXGNX-VYXXYXFFSA-N. The full InChI is InChI=1S/C13H16/c1-4-11(2)9-10-13-8-6-5-7-12(13)3/h5-10H,3-4H2,1-2H3/b11-9-,13-10-.
What are the key properties of (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene?
(6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene has a molecular weight of 172.27 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-5-methylidene-6-[(Z)-3-methylpent-2-enylidene]cyclohexa-1,3-diene is sourced from PubChem (CID 143026657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).