(Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine

C9H17N — CID 89174706

IUPAC(Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine
SMILESC/C=C\C(=C/C)CNCC
InChIInChI=1S/C9H17N/c1-4-7-9(5-2)8-10-6-3/h4-5,7,10H,6,8H2,1-3H3/b7-4-,9-5+
InChIKeyMYTZFBGALKPXFA-ICDOWURLSA-N
MW139.24 g/mol
LogP2.12
Rot. Bonds4

About (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine

(Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine (PubChem CID 89174706) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine.

Molecular Properties

Compound Name(Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine
PubChem CID89174706
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name(Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine
SMILESC/C=C\C(=C/C)CNCC
InChIInChI=1S/C9H17N/c1-4-7-9(5-2)8-10-6-3/h4-5,7,10H,6,8H2,1-3H3/b7-4-,9-5+
InChIKeyMYTZFBGALKPXFA-ICDOWURLSA-N
XLogP2.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (Z,2E)-N-ethyl-2-ethylidenepent-3-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 (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine?
The IUPAC name of (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine (CID 89174706) is (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine.
What is the SMILES notation for (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine?
The canonical SMILES for (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine is C/C=C\C(=C/C)CNCC.
What is the InChIKey of (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine?
The InChIKey is MYTZFBGALKPXFA-ICDOWURLSA-N. The full InChI is InChI=1S/C9H17N/c1-4-7-9(5-2)8-10-6-3/h4-5,7,10H,6,8H2,1-3H3/b7-4-,9-5+.
What are the key properties of (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine?
(Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine has a molecular weight of 139.24 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2E)-N-ethyl-2-ethylidenepent-3-en-1-amine is sourced from PubChem (CID 89174706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).