(8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine

C10H16N2 — CID 89173672

IUPAC(8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine
SMILESC=C1CCC/C(C)=C/N=C(/N)C1
InChIInChI=1S/C10H16N2/c1-8-4-3-5-9(2)7-12-10(11)6-8/h7H,1,3-6H2,2H3,(H2,11,12)/b9-7+
InChIKeyJQHPZKAGWLCRBC-VQHVLOKHSA-N
MW164.25 g/mol
LogP2.38
Rot. Bonds

About (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine

(8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine (PubChem CID 89173672) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine.

Molecular Properties

Compound Name(8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine
PubChem CID89173672
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name(8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine
SMILESC=C1CCC/C(C)=C/N=C(/N)C1
InChIInChI=1S/C10H16N2/c1-8-4-3-5-9(2)7-12-10(11)6-8/h7H,1,3-6H2,2H3,(H2,11,12)/b9-7+
InChIKeyJQHPZKAGWLCRBC-VQHVLOKHSA-N
XLogP2.38
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine?
The IUPAC name of (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine (CID 89173672) is (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine.
What is the SMILES notation for (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine?
The canonical SMILES for (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine is C=C1CCC/C(C)=C/N=C(/N)C1.
What is the InChIKey of (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine?
The InChIKey is JQHPZKAGWLCRBC-VQHVLOKHSA-N. The full InChI is InChI=1S/C10H16N2/c1-8-4-3-5-9(2)7-12-10(11)6-8/h7H,1,3-6H2,2H3,(H2,11,12)/b9-7+.
What are the key properties of (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine?
(8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine has a molecular weight of 164.25 g/mol, XLogP of 2.38, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8E)-8-methyl-4-methylidene-3,5,6,7-tetrahydroazonin-2-amine is sourced from PubChem (CID 89173672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).