(E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine

C12H24N2 — CID 134567900

IUPAC(E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine
SMILESCCCCCC(=N\C)/C(C)=C(\C)NC
InChIInChI=1S/C12H24N2/c1-6-7-8-9-12(14-5)10(2)11(3)13-4/h13H,6-9H2,1-5H3/b11-10+,14-12+
InChIKeyRMGLGHZAXXEKNU-CYZWUHAYSA-N
MW196.34 g/mol
LogP3.15
Rot. Bonds6

About (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine

(E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine (PubChem CID 134567900) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine.

Molecular Properties

Compound Name(E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine
PubChem CID134567900
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name(E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine
SMILESCCCCCC(=N\C)/C(C)=C(\C)NC
InChIInChI=1S/C12H24N2/c1-6-7-8-9-12(14-5)10(2)11(3)13-4/h13H,6-9H2,1-5H3/b11-10+,14-12+
InChIKeyRMGLGHZAXXEKNU-CYZWUHAYSA-N
XLogP3.15
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine?
The IUPAC name of (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine (CID 134567900) is (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine.
What is the SMILES notation for (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine?
The canonical SMILES for (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine is CCCCCC(=N\C)/C(C)=C(\C)NC.
What is the InChIKey of (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine?
The InChIKey is RMGLGHZAXXEKNU-CYZWUHAYSA-N. The full InChI is InChI=1S/C12H24N2/c1-6-7-8-9-12(14-5)10(2)11(3)13-4/h13H,6-9H2,1-5H3/b11-10+,14-12+.
What are the key properties of (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine?
(E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine has a molecular weight of 196.34 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine is sourced from PubChem (CID 134567900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).