(6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene

C16H22 — CID 134993743

IUPAC(6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene
SMILESC1=C\CCCCc2ccc(cc2)CCCC/1
InChIInChI=1S/C16H22/c1-2-4-6-8-10-16-13-11-15(12-14-16)9-7-5-3-1/h1-2,11-14H,3-10H2/b2-1-
InChIKeyBLQILTDIGHNHLD-UPHRSURJSA-N
MW214.35 g/mol
LogP4.68
Rot. Bonds

About (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene

(6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene (PubChem CID 134993743) has the molecular formula C16H22 and a molecular weight of 214.35 g/mol. Its IUPAC name is (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene.

Molecular Properties

Compound Name(6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene
PubChem CID134993743
Molecular FormulaC16H22
Molecular Weight214.35 g/mol
Exact Mass214.17
IUPAC Name(6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene
SMILESC1=C\CCCCc2ccc(cc2)CCCC/1
InChIInChI=1S/C16H22/c1-2-4-6-8-10-16-13-11-15(12-14-16)9-7-5-3-1/h1-2,11-14H,3-10H2/b2-1-
InChIKeyBLQILTDIGHNHLD-UPHRSURJSA-N
XLogP4.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 54.68
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

(5E)-bicyclo[8.2.2]tetradeca-1(12),5,10,13-tetraene
CID 15562414
(1E,7E)-cyclododeca-1,7-diene
CID 6477773
(7Z)-cyclododec-7-ene-1,2-dione
CID 15642693
(6E,10Z)-cyclopentadeca-6,10-dien-1-one
CID 12036583
cyclohexanone;cyclohexene
CID 67659841
(10Z)-cycloicos-10-en-1-one
CID 11254844
(8Z)-cycloheptadec-8-ene-1,2-dione
CID 70189599
(7Z)-cyclohexadeca-1,7-diene
CID 173129118
cyclopentadecene
CID 5463009
(1E,8E)-cyclotetradeca-1,8-diene
CID 638080
(5Z)-cyclodeca-1,5-diene
CID 97293620
(1E)-cyclooctadeca-1,8-diene
CID 173129359

Frequently Asked Questions

What is the IUPAC name of (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene?
The IUPAC name of (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene (CID 134993743) is (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene.
What is the SMILES notation for (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene?
The canonical SMILES for (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene is C1=C\CCCCc2ccc(cc2)CCCC/1.
What is the InChIKey of (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene?
The InChIKey is BLQILTDIGHNHLD-UPHRSURJSA-N. The full InChI is InChI=1S/C16H22/c1-2-4-6-8-10-16-13-11-15(12-14-16)9-7-5-3-1/h1-2,11-14H,3-10H2/b2-1-.
What are the key properties of (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene?
(6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene has a molecular weight of 214.35 g/mol, XLogP of 4.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-bicyclo[10.2.2]hexadeca-1(14),6,12,15-tetraene is sourced from PubChem (CID 134993743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).