7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene

C11H13N — CID 143104049

IUPAC7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene
SMILESCC1=CC2=CC(C=CC=C2)N1C
InChIInChI=1S/C11H13N/c1-9-7-10-5-3-4-6-11(8-10)12(9)2/h3-8,11H,1-2H3
InChIKeyYVMZIVYPQBJLMF-UHFFFAOYSA-N
MW159.23 g/mol
LogP2.26
Rot. Bonds

About 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene

7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene (PubChem CID 143104049) has the molecular formula C11H13N and a molecular weight of 159.23 g/mol. Its IUPAC name is 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene.

Molecular Properties

Compound Name7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene
PubChem CID143104049
Molecular FormulaC11H13N
Molecular Weight159.23 g/mol
Exact Mass159.10
IUPAC Name7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene
SMILESCC1=CC2=CC(C=CC=C2)N1C
InChIInChI=1S/C11H13N/c1-9-7-10-5-3-4-6-11(8-10)12(9)2/h3-8,11H,1-2H3
InChIKeyYVMZIVYPQBJLMF-UHFFFAOYSA-N
XLogP2.26
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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8-iodo-5,6-dimethyl-8-azatricyclo[7.4.1.02,7]tetradeca-1(14),2(7),3,5,10,12-hexaene
CID 167289769
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CID 137429134
(2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one
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Frequently Asked Questions

What is the IUPAC name of 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene?
The IUPAC name of 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene (CID 143104049) is 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene.
What is the SMILES notation for 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene?
The canonical SMILES for 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene is CC1=CC2=CC(C=CC=C2)N1C.
What is the InChIKey of 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene?
The InChIKey is YVMZIVYPQBJLMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N/c1-9-7-10-5-3-4-6-11(8-10)12(9)2/h3-8,11H,1-2H3.
What are the key properties of 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene?
7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene has a molecular weight of 159.23 g/mol, XLogP of 2.26, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dimethyl-7-azabicyclo[4.3.1]deca-1(10),2,4,8-tetraene is sourced from PubChem (CID 143104049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).