(8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene

C11H17N — CID 70658421

IUPAC(8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene
SMILESCC1C/C=N\C=C\C=C\CCC1
InChIInChI=1S/C11H17N/c1-11-7-5-3-2-4-6-9-12-10-8-11/h2,4,6,9-11H,3,5,7-8H2,1H3/b4-2+,9-6+,12-10-
InChIKeyOKGRJPJIHICFAH-DYZKTZTESA-N
MW163.26 g/mol
LogP3.34
Rot. Bonds

About (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene

(8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene (PubChem CID 70658421) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene.

Molecular Properties

Compound Name(8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene
PubChem CID70658421
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name(8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene
SMILESCC1C/C=N\C=C\C=C\CCC1
InChIInChI=1S/C11H17N/c1-11-7-5-3-2-4-6-9-12-10-8-11/h2,4,6,9-11H,3,5,7-8H2,1H3/b4-2+,9-6+,12-10-
InChIKeyOKGRJPJIHICFAH-DYZKTZTESA-N
XLogP3.34
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene?
The IUPAC name of (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene (CID 70658421) is (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene.
What is the SMILES notation for (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene?
The canonical SMILES for (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene is CC1C/C=N\C=C\C=C\CCC1.
What is the InChIKey of (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene?
The InChIKey is OKGRJPJIHICFAH-DYZKTZTESA-N. The full InChI is InChI=1S/C11H17N/c1-11-7-5-3-2-4-6-9-12-10-8-11/h2,4,6,9-11H,3,5,7-8H2,1H3/b4-2+,9-6+,12-10-.
What are the key properties of (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene?
(8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene has a molecular weight of 163.26 g/mol, XLogP of 3.34, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8E,10E)-4-methyl-1-azacycloundeca-1,8,10-triene is sourced from PubChem (CID 70658421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).