2-[amino(oxido)amino]propan-2-ol

C3H9N2O2- — CID 163562272

IUPAC2-[amino(oxido)amino]propan-2-ol
SMILESCC(C)(O)N(N)[O-]
InChIInChI=1S/C3H9N2O2/c1-3(2,6)5(4)7/h6H,4H2,1-2H3/q-1
InChIKeyPNZZFWLXYQLNSH-UHFFFAOYSA-N
MW105.12 g/mol
LogP-0.61
Rot. Bonds1

About 2-[amino(oxido)amino]propan-2-ol

2-[amino(oxido)amino]propan-2-ol (PubChem CID 163562272) has the molecular formula C3H9N2O2- and a molecular weight of 105.12 g/mol. Its IUPAC name is 2-[amino(oxido)amino]propan-2-ol.

Molecular Properties

Compound Name2-[amino(oxido)amino]propan-2-ol
PubChem CID163562272
Molecular FormulaC3H9N2O2-
Molecular Weight105.12 g/mol
Exact Mass105.07
IUPAC Name2-[amino(oxido)amino]propan-2-ol
SMILESCC(C)(O)N(N)[O-]
InChIInChI=1S/C3H9N2O2/c1-3(2,6)5(4)7/h6H,4H2,1-2H3/q-1
InChIKeyPNZZFWLXYQLNSH-UHFFFAOYSA-N
XLogP-0.61
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.12
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[amino(oxido)amino]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(dimethylamino)propan-2-ol
CID 11251968
azane;2-methylpropan-2-ol;hydrobromide
CID 173305013
azane;1,1-bis(dimethylamino)ethanol
CID 87415639
azane;3-methylpentan-3-ol
CID 87107560
2-[diazenyl(oxido)amino]propan-2-ol
CID 163568258
2-[bis(1-hydroxyethyl)amino]propan-2-ol;hydrochloride
CID 175101401
potassium 1,1-dihydroxyethanolate
CID 142786674
alumane;2-aminopropan-2-ol
CID 175409057
2-aminopropan-2-ol;copper
CID 87854275
1-aminoethane-1,1-diol;hydrochloride
CID 173034802
2-[amino(methyl)amino]butan-2-ol
CID 142701934
1-amino-1-bromoethanol
CID 158110209

Frequently Asked Questions

What is the IUPAC name of 2-[amino(oxido)amino]propan-2-ol?
The IUPAC name of 2-[amino(oxido)amino]propan-2-ol (CID 163562272) is 2-[amino(oxido)amino]propan-2-ol.
What is the SMILES notation for 2-[amino(oxido)amino]propan-2-ol?
The canonical SMILES for 2-[amino(oxido)amino]propan-2-ol is CC(C)(O)N(N)[O-].
What is the InChIKey of 2-[amino(oxido)amino]propan-2-ol?
The InChIKey is PNZZFWLXYQLNSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N2O2/c1-3(2,6)5(4)7/h6H,4H2,1-2H3/q-1.
What are the key properties of 2-[amino(oxido)amino]propan-2-ol?
2-[amino(oxido)amino]propan-2-ol has a molecular weight of 105.12 g/mol, XLogP of -0.61, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[amino(oxido)amino]propan-2-ol is sourced from PubChem (CID 163562272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).