(11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene

C20H24N2O — CID 162658567

IUPAC(11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene
SMILESCOc1ccc2c(c1)CN(C)[C@@]1(c3ccccc3)CCN(C2)C1
InChIInChI=1S/C20H24N2O/c1-21-13-17-12-19(23-2)9-8-16(17)14-22-11-10-20(21,15-22)18-6-4-3-5-7-18/h3-9,12H,10-11,13-15H2,1-2H3/t20-/m0/s1
InChIKeyFLSQHFIODMJWMG-FQEVSTJZSA-N
MW308.43 g/mol
LogP3.24
Rot. Bonds2

About (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene

(11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene (PubChem CID 162658567) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene.

Molecular Properties

Compound Name(11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene
PubChem CID162658567
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name(11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene
SMILESCOc1ccc2c(c1)CN(C)[C@@]1(c3ccccc3)CCN(C2)C1
InChIInChI=1S/C20H24N2O/c1-21-13-17-12-19(23-2)9-8-16(17)14-22-11-10-20(21,15-22)18-6-4-3-5-7-18/h3-9,12H,10-11,13-15H2,1-2H3/t20-/m0/s1
InChIKeyFLSQHFIODMJWMG-FQEVSTJZSA-N
XLogP3.24
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene?
The IUPAC name of (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene (CID 162658567) is (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene.
What is the SMILES notation for (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene?
The canonical SMILES for (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene is COc1ccc2c(c1)CN(C)[C@@]1(c3ccccc3)CCN(C2)C1.
What is the InChIKey of (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene?
The InChIKey is FLSQHFIODMJWMG-FQEVSTJZSA-N. The full InChI is InChI=1S/C20H24N2O/c1-21-13-17-12-19(23-2)9-8-16(17)14-22-11-10-20(21,15-22)18-6-4-3-5-7-18/h3-9,12H,10-11,13-15H2,1-2H3/t20-/m0/s1.
What are the key properties of (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene?
(11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene has a molecular weight of 308.43 g/mol, XLogP of 3.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (11R)-6-methoxy-10-methyl-11-phenyl-1,10-diazatricyclo[9.2.1.03,8]tetradeca-3(8),4,6-triene is sourced from PubChem (CID 162658567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).