1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene

C15H21N — CID 3041078

IUPAC1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene
SMILESCC1C2Cc3ccccc3C1(C)CCN2C
InChIInChI=1S/C15H21N/c1-11-14-10-12-6-4-5-7-13(12)15(11,2)8-9-16(14)3/h4-7,11,14H,8-10H2,1-3H3
InChIKeyUPIJLTVYDZRYJT-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.84
Rot. Bonds

About 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene

1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene (PubChem CID 3041078) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene.

Molecular Properties

Compound Name1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene
PubChem CID3041078
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene
SMILESCC1C2Cc3ccccc3C1(C)CCN2C
InChIInChI=1S/C15H21N/c1-11-14-10-12-6-4-5-7-13(12)15(11,2)8-9-16(14)3/h4-7,11,14H,8-10H2,1-3H3
InChIKeyUPIJLTVYDZRYJT-UHFFFAOYSA-N
XLogP2.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene?
The IUPAC name of 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene (CID 3041078) is 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene.
What is the SMILES notation for 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene?
The canonical SMILES for 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene is CC1C2Cc3ccccc3C1(C)CCN2C.
What is the InChIKey of 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene?
The InChIKey is UPIJLTVYDZRYJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-11-14-10-12-6-4-5-7-13(12)15(11,2)8-9-16(14)3/h4-7,11,14H,8-10H2,1-3H3.
What are the key properties of 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene?
1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene has a molecular weight of 215.34 g/mol, XLogP of 2.84, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene is sourced from PubChem (CID 3041078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).