(4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine

C9H13N — CID 89316667

IUPAC(4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine
SMILESC/C1=C\C=C/C=C/CCN1
InChIInChI=1S/C9H13N/c1-9-7-5-3-2-4-6-8-10-9/h2-5,7,10H,6,8H2,1H3/b4-2+,5-3-,9-7+
InChIKeyRCDBJWJFFSTEHC-BUJGYVBMSA-N
MW135.21 g/mol
LogP2.00
Rot. Bonds

About (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine

(4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine (PubChem CID 89316667) has the molecular formula C9H13N and a molecular weight of 135.21 g/mol. Its IUPAC name is (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine.

Molecular Properties

Compound Name(4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine
PubChem CID89316667
Molecular FormulaC9H13N
Molecular Weight135.21 g/mol
Exact Mass135.10
IUPAC Name(4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine
SMILESC/C1=C\C=C/C=C/CCN1
InChIInChI=1S/C9H13N/c1-9-7-5-3-2-4-6-8-10-9/h2-5,7,10H,6,8H2,1H3/b4-2+,5-3-,9-7+
InChIKeyRCDBJWJFFSTEHC-BUJGYVBMSA-N
XLogP2.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.21
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine?
The IUPAC name of (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine (CID 89316667) is (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine.
What is the SMILES notation for (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine?
The canonical SMILES for (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine is C/C1=C\C=C/C=C/CCN1.
What is the InChIKey of (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine?
The InChIKey is RCDBJWJFFSTEHC-BUJGYVBMSA-N. The full InChI is InChI=1S/C9H13N/c1-9-7-5-3-2-4-6-8-10-9/h2-5,7,10H,6,8H2,1H3/b4-2+,5-3-,9-7+.
What are the key properties of (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine?
(4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine has a molecular weight of 135.21 g/mol, XLogP of 2.00, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,6Z,8E)-9-methyl-2,3-dihydro-1H-azonine is sourced from PubChem (CID 89316667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).