O-[3-(3-aminopropylamino)propyl]hydroxylamine

C6H17N3O — CID 10441831

IUPACO-[3-(3-aminopropylamino)propyl]hydroxylamine
SMILESNCCCNCCCON
InChIInChI=1S/C6H17N3O/c7-3-1-4-9-5-2-6-10-8/h9H,1-8H2
InChIKeyBYJFKBSBZKZNDL-UHFFFAOYSA-N
MW147.22 g/mol
LogP-0.79
Rot. Bonds7

About O-[3-(3-aminopropylamino)propyl]hydroxylamine

O-[3-(3-aminopropylamino)propyl]hydroxylamine (PubChem CID 10441831) has the molecular formula C6H17N3O and a molecular weight of 147.22 g/mol. Its IUPAC name is O-[3-(3-aminopropylamino)propyl]hydroxylamine.

Molecular Properties

Compound NameO-[3-(3-aminopropylamino)propyl]hydroxylamine
PubChem CID10441831
Molecular FormulaC6H17N3O
Molecular Weight147.22 g/mol
Exact Mass147.14
IUPAC NameO-[3-(3-aminopropylamino)propyl]hydroxylamine
SMILESNCCCNCCCON
InChIInChI=1S/C6H17N3O/c7-3-1-4-9-5-2-6-10-8/h9H,1-8H2
InChIKeyBYJFKBSBZKZNDL-UHFFFAOYSA-N
XLogP-0.79
TPSA73.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 5-0.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of O-[3-(3-aminopropylamino)propyl]hydroxylamine?
The IUPAC name of O-[3-(3-aminopropylamino)propyl]hydroxylamine (CID 10441831) is O-[3-(3-aminopropylamino)propyl]hydroxylamine.
What is the SMILES notation for O-[3-(3-aminopropylamino)propyl]hydroxylamine?
The canonical SMILES for O-[3-(3-aminopropylamino)propyl]hydroxylamine is NCCCNCCCON.
What is the InChIKey of O-[3-(3-aminopropylamino)propyl]hydroxylamine?
The InChIKey is BYJFKBSBZKZNDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17N3O/c7-3-1-4-9-5-2-6-10-8/h9H,1-8H2.
What are the key properties of O-[3-(3-aminopropylamino)propyl]hydroxylamine?
O-[3-(3-aminopropylamino)propyl]hydroxylamine has a molecular weight of 147.22 g/mol, XLogP of -0.79, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-[3-(3-aminopropylamino)propyl]hydroxylamine is sourced from PubChem (CID 10441831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).