11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene

C11H14N2O — CID 174160424

IUPAC11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene
SMILESc1onc2c1CC1C2CC2CCCN21
InChIInChI=1S/C11H14N2O/c1-2-8-5-9-10(13(8)3-1)4-7-6-14-12-11(7)9/h6,8-10H,1-5H2
InChIKeyINDNGVFKQHHYON-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.55
Rot. Bonds

About 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene

11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene (PubChem CID 174160424) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene.

Molecular Properties

Compound Name11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene
PubChem CID174160424
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene
SMILESc1onc2c1CC1C2CC2CCCN21
InChIInChI=1S/C11H14N2O/c1-2-8-5-9-10(13(8)3-1)4-7-6-14-12-11(7)9/h6,8-10H,1-5H2
InChIKeyINDNGVFKQHHYON-UHFFFAOYSA-N
XLogP1.55
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene?
The IUPAC name of 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene (CID 174160424) is 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene.
What is the SMILES notation for 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene?
The canonical SMILES for 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene is c1onc2c1CC1C2CC2CCCN21.
What is the InChIKey of 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene?
The InChIKey is INDNGVFKQHHYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-2-8-5-9-10(13(8)3-1)4-7-6-14-12-11(7)9/h6,8-10H,1-5H2.
What are the key properties of 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene?
11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene has a molecular weight of 190.25 g/mol, XLogP of 1.55, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-oxa-2,10-diazatetracyclo[6.6.0.02,6.09,13]tetradeca-9,12-diene is sourced from PubChem (CID 174160424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).