6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene

C19H23NO2 — CID 10402378

IUPAC6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene
SMILESCOc1ccc2c(c1)OCCN(C)CCc1ccccc1C2
InChIInChI=1S/C19H23NO2/c1-20-10-9-15-5-3-4-6-16(15)13-17-7-8-18(21-2)14-19(17)22-12-11-20/h3-8,14H,9-13H2,1-2H3
InChIKeyQIMZPHYIPMOZHG-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.15
Rot. Bonds1

About 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene

6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene (PubChem CID 10402378) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene.

Molecular Properties

Compound Name6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene
PubChem CID10402378
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene
SMILESCOc1ccc2c(c1)OCCN(C)CCc1ccccc1C2
InChIInChI=1S/C19H23NO2/c1-20-10-9-15-5-3-4-6-16(15)13-17-7-8-18(21-2)14-19(17)22-12-11-20/h3-8,14H,9-13H2,1-2H3
InChIKeyQIMZPHYIPMOZHG-UHFFFAOYSA-N
XLogP3.15
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene 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 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene?
The IUPAC name of 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene (CID 10402378) is 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene.
What is the SMILES notation for 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene?
The canonical SMILES for 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene is COc1ccc2c(c1)OCCN(C)CCc1ccccc1C2.
What is the InChIKey of 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene?
The InChIKey is QIMZPHYIPMOZHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-20-10-9-15-5-3-4-6-16(15)13-17-7-8-18(21-2)14-19(17)22-12-11-20/h3-8,14H,9-13H2,1-2H3.
What are the key properties of 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene?
6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene has a molecular weight of 297.40 g/mol, XLogP of 3.15, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-12-methyl-9-oxa-12-azatricyclo[13.4.0.03,8]nonadeca-1(19),3(8),4,6,15,17-hexaene is sourced from PubChem (CID 10402378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).