(E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine

C11H23N — CID 167099818

IUPAC(E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine
SMILESCC(C)/C=C/CN(C)CC(C)C
InChIInChI=1S/C11H23N/c1-10(2)7-6-8-12(5)9-11(3)4/h6-7,10-11H,8-9H2,1-5H3/b7-6+
InChIKeyMXPYSRIUAMIHIY-VOTSOKGWSA-N
MW169.31 g/mol
LogP2.79
Rot. Bonds5

About (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine

(E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine (PubChem CID 167099818) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine.

Molecular Properties

Compound Name(E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine
PubChem CID167099818
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name(E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine
SMILESCC(C)/C=C/CN(C)CC(C)C
InChIInChI=1S/C11H23N/c1-10(2)7-6-8-12(5)9-11(3)4/h6-7,10-11H,8-9H2,1-5H3/b7-6+
InChIKeyMXPYSRIUAMIHIY-VOTSOKGWSA-N
XLogP2.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine?
The IUPAC name of (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine (CID 167099818) is (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine.
What is the SMILES notation for (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine?
The canonical SMILES for (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine is CC(C)/C=C/CN(C)CC(C)C.
What is the InChIKey of (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine?
The InChIKey is MXPYSRIUAMIHIY-VOTSOKGWSA-N. The full InChI is InChI=1S/C11H23N/c1-10(2)7-6-8-12(5)9-11(3)4/h6-7,10-11H,8-9H2,1-5H3/b7-6+.
What are the key properties of (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine?
(E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.79, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine is sourced from PubChem (CID 167099818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).