O-(3-aminohex-5-enyl)hydroxylamine

C6H14N2O — CID 146223929

IUPACO-(3-aminohex-5-enyl)hydroxylamine
SMILESC=CCC(N)CCON
InChIInChI=1S/C6H14N2O/c1-2-3-6(7)4-5-9-8/h2,6H,1,3-5,7-8H2
InChIKeyCXFOOUYXDLWYJK-UHFFFAOYSA-N
MW130.19 g/mol
LogP0.17
Rot. Bonds5

About O-(3-aminohex-5-enyl)hydroxylamine

O-(3-aminohex-5-enyl)hydroxylamine (PubChem CID 146223929) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is O-(3-aminohex-5-enyl)hydroxylamine.

Molecular Properties

Compound NameO-(3-aminohex-5-enyl)hydroxylamine
PubChem CID146223929
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC NameO-(3-aminohex-5-enyl)hydroxylamine
SMILESC=CCC(N)CCON
InChIInChI=1S/C6H14N2O/c1-2-3-6(7)4-5-9-8/h2,6H,1,3-5,7-8H2
InChIKeyCXFOOUYXDLWYJK-UHFFFAOYSA-N
XLogP0.17
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze O-(3-aminohex-5-enyl)hydroxylamine 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 O-(3-aminohex-5-enyl)hydroxylamine?
The IUPAC name of O-(3-aminohex-5-enyl)hydroxylamine (CID 146223929) is O-(3-aminohex-5-enyl)hydroxylamine.
What is the SMILES notation for O-(3-aminohex-5-enyl)hydroxylamine?
The canonical SMILES for O-(3-aminohex-5-enyl)hydroxylamine is C=CCC(N)CCON.
What is the InChIKey of O-(3-aminohex-5-enyl)hydroxylamine?
The InChIKey is CXFOOUYXDLWYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-2-3-6(7)4-5-9-8/h2,6H,1,3-5,7-8H2.
What are the key properties of O-(3-aminohex-5-enyl)hydroxylamine?
O-(3-aminohex-5-enyl)hydroxylamine has a molecular weight of 130.19 g/mol, XLogP of 0.17, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(3-aminohex-5-enyl)hydroxylamine is sourced from PubChem (CID 146223929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).