N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine

C6H16N4 — CID 15244611

IUPACN'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine
SMILES[H]/N=C/CN(CCN)CCN
InChIInChI=1S/C6H16N4/c7-1-4-10(5-2-8)6-3-9/h1,7H,2-6,8-9H2/b7-1+
InChIKeyLCLAOJJCXCQGSO-LREOWRDNSA-N
MW144.22 g/mol
LogP-1.14
Rot. Bonds6

About N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine

N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine (PubChem CID 15244611) has the molecular formula C6H16N4 and a molecular weight of 144.22 g/mol. Its IUPAC name is N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine
PubChem CID15244611
Molecular FormulaC6H16N4
Molecular Weight144.22 g/mol
Exact Mass144.14
IUPAC NameN'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine
SMILES[H]/N=C/CN(CCN)CCN
InChIInChI=1S/C6H16N4/c7-1-4-10(5-2-8)6-3-9/h1,7H,2-6,8-9H2/b7-1+
InChIKeyLCLAOJJCXCQGSO-LREOWRDNSA-N
XLogP-1.14
TPSA79.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-1.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine 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 N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine?
The IUPAC name of N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine (CID 15244611) is N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine?
The canonical SMILES for N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine is [H]/N=C/CN(CCN)CCN.
What is the InChIKey of N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine?
The InChIKey is LCLAOJJCXCQGSO-LREOWRDNSA-N. The full InChI is InChI=1S/C6H16N4/c7-1-4-10(5-2-8)6-3-9/h1,7H,2-6,8-9H2/b7-1+.
What are the key properties of N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine?
N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine has a molecular weight of 144.22 g/mol, XLogP of -1.14, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-aminoethyl)-N'-(2-iminoethyl)ethane-1,2-diamine is sourced from PubChem (CID 15244611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).