13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene

C14H14N2O — CID 59747553

IUPAC13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene
SMILESCC1c2c(oc3ccccc23)N2C=CN(C)C12
InChIInChI=1S/C14H14N2O/c1-9-12-10-5-3-4-6-11(10)17-14(12)16-8-7-15(2)13(9)16/h3-9,13H,1-2H3
InChIKeyPBOIEVBOZAODBA-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.10
Rot. Bonds

About 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene

13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene (PubChem CID 59747553) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene.

Molecular Properties

Compound Name13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene
PubChem CID59747553
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene
SMILESCC1c2c(oc3ccccc23)N2C=CN(C)C12
InChIInChI=1S/C14H14N2O/c1-9-12-10-5-3-4-6-11(10)17-14(12)16-8-7-15(2)13(9)16/h3-9,13H,1-2H3
InChIKeyPBOIEVBOZAODBA-UHFFFAOYSA-N
XLogP3.10
TPSA19.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene?
The IUPAC name of 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene (CID 59747553) is 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene.
What is the SMILES notation for 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene?
The canonical SMILES for 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene is CC1c2c(oc3ccccc23)N2C=CN(C)C12.
What is the InChIKey of 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene?
The InChIKey is PBOIEVBOZAODBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-9-12-10-5-3-4-6-11(10)17-14(12)16-8-7-15(2)13(9)16/h3-9,13H,1-2H3.
What are the key properties of 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene?
13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene has a molecular weight of 226.28 g/mol, XLogP of 3.10, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 13,15-dimethyl-8-oxa-10,13-diazatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,11-pentaene is sourced from PubChem (CID 59747553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).