16-oxabicyclo[10.3.1]hexadec-1(15)-ene

C15H26O — CID 71323614

IUPAC16-oxabicyclo[10.3.1]hexadec-1(15)-ene
SMILESC1=C2CCCCCCCCCCC(CC1)O2
InChIInChI=1S/C15H26O/c1-2-4-6-8-11-15-13-9-12-14(16-15)10-7-5-3-1/h12,15H,1-11,13H2
InChIKeyNLXIBWRIRQJZIP-UHFFFAOYSA-N
MW222.37 g/mol
LogP4.96
Rot. Bonds

About 16-oxabicyclo[10.3.1]hexadec-1(15)-ene

16-oxabicyclo[10.3.1]hexadec-1(15)-ene (PubChem CID 71323614) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 16-oxabicyclo[10.3.1]hexadec-1(15)-ene.

Molecular Properties

Compound Name16-oxabicyclo[10.3.1]hexadec-1(15)-ene
PubChem CID71323614
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name16-oxabicyclo[10.3.1]hexadec-1(15)-ene
SMILESC1=C2CCCCCCCCCCC(CC1)O2
InChIInChI=1S/C15H26O/c1-2-4-6-8-11-15-13-9-12-14(16-15)10-7-5-3-1/h12,15H,1-11,13H2
InChIKeyNLXIBWRIRQJZIP-UHFFFAOYSA-N
XLogP4.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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trans-1-Methoxycyclododecene
CID 5463037
1-Propoxycyclohex-1-ene
CID 20071904
1-Butoxycyclohexene
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CID 11768791
5-Hexyl-2,3-dihydrofuran
CID 12399568

Frequently Asked Questions

What is the IUPAC name of 16-oxabicyclo[10.3.1]hexadec-1(15)-ene?
The IUPAC name of 16-oxabicyclo[10.3.1]hexadec-1(15)-ene (CID 71323614) is 16-oxabicyclo[10.3.1]hexadec-1(15)-ene.
What is the SMILES notation for 16-oxabicyclo[10.3.1]hexadec-1(15)-ene?
The canonical SMILES for 16-oxabicyclo[10.3.1]hexadec-1(15)-ene is C1=C2CCCCCCCCCCC(CC1)O2.
What is the InChIKey of 16-oxabicyclo[10.3.1]hexadec-1(15)-ene?
The InChIKey is NLXIBWRIRQJZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O/c1-2-4-6-8-11-15-13-9-12-14(16-15)10-7-5-3-1/h12,15H,1-11,13H2.
What are the key properties of 16-oxabicyclo[10.3.1]hexadec-1(15)-ene?
16-oxabicyclo[10.3.1]hexadec-1(15)-ene has a molecular weight of 222.37 g/mol, XLogP of 4.96, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 16-oxabicyclo[10.3.1]hexadec-1(15)-ene is sourced from PubChem (CID 71323614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).