N-(2-aminoethyl)hydroxylamine;ethane

C4H14N2O — CID 22159513

IUPACN-(2-aminoethyl)hydroxylamine;ethane
SMILESCC.NCCNO
InChIInChI=1S/C2H8N2O.C2H6/c3-1-2-4-5;1-2/h4-5H,1-3H2;1-2H3
InChIKeyANNZAEKCBQGGCM-UHFFFAOYSA-N
MW106.17 g/mol
LogP-0.05
Rot. Bonds2

About N-(2-aminoethyl)hydroxylamine;ethane

N-(2-aminoethyl)hydroxylamine;ethane (PubChem CID 22159513) has the molecular formula C4H14N2O and a molecular weight of 106.17 g/mol. Its IUPAC name is N-(2-aminoethyl)hydroxylamine;ethane.

Molecular Properties

Compound NameN-(2-aminoethyl)hydroxylamine;ethane
PubChem CID22159513
Molecular FormulaC4H14N2O
Molecular Weight106.17 g/mol
Exact Mass106.11
IUPAC NameN-(2-aminoethyl)hydroxylamine;ethane
SMILESCC.NCCNO
InChIInChI=1S/C2H8N2O.C2H6/c3-1-2-4-5;1-2/h4-5H,1-3H2;1-2H3
InChIKeyANNZAEKCBQGGCM-UHFFFAOYSA-N
XLogP-0.05
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.17
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(2-aminoethyl)hydroxylamine;ethane 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)hydroxylamine;ethane?
The IUPAC name of N-(2-aminoethyl)hydroxylamine;ethane (CID 22159513) is N-(2-aminoethyl)hydroxylamine;ethane.
What is the SMILES notation for N-(2-aminoethyl)hydroxylamine;ethane?
The canonical SMILES for N-(2-aminoethyl)hydroxylamine;ethane is CC.NCCNO.
What is the InChIKey of N-(2-aminoethyl)hydroxylamine;ethane?
The InChIKey is ANNZAEKCBQGGCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8N2O.C2H6/c3-1-2-4-5;1-2/h4-5H,1-3H2;1-2H3.
What are the key properties of N-(2-aminoethyl)hydroxylamine;ethane?
N-(2-aminoethyl)hydroxylamine;ethane has a molecular weight of 106.17 g/mol, XLogP of -0.05, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)hydroxylamine;ethane is sourced from PubChem (CID 22159513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).