azane;propanehydrazide;hydroiodide

C3H12IN3O — CID 174716911

IUPACazane;propanehydrazide;hydroiodide
SMILESCCC(=O)NN.I.N
InChIInChI=1S/C3H8N2O.HI.H3N/c1-2-3(6)5-4;;/h2,4H2,1H3,(H,5,6);1H;1H3
InChIKeySSGACDPDWPTBCZ-UHFFFAOYSA-N
MW233.05 g/mol
LogP0.17
Rot. Bonds1

About azane;propanehydrazide;hydroiodide

azane;propanehydrazide;hydroiodide (PubChem CID 174716911) has the molecular formula C3H12IN3O and a molecular weight of 233.05 g/mol. Its IUPAC name is azane;propanehydrazide;hydroiodide.

Molecular Properties

Compound Nameazane;propanehydrazide;hydroiodide
PubChem CID174716911
Molecular FormulaC3H12IN3O
Molecular Weight233.05 g/mol
Exact Mass233.00
IUPAC Nameazane;propanehydrazide;hydroiodide
SMILESCCC(=O)NN.I.N
InChIInChI=1S/C3H8N2O.HI.H3N/c1-2-3(6)5-4;;/h2,4H2,1H3,(H,5,6);1H;1H3
InChIKeySSGACDPDWPTBCZ-UHFFFAOYSA-N
XLogP0.17
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.05
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

propanehydrazide;dihydrochloride
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butanedihydrazide;hydrochloride
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2-(methylamino)acetohydrazide
CID 22479968
1-amino-2-methyl-3-(propanoylamino)guanidine
CID 55280595
2-ethoxyacetohydrazide;hydrochloride
CID 16641296
2-[2,4,6-triethyl-3,5-bis(2-hydrazinyl-2-oxoethyl)phenyl]acetohydrazide
CID 91021399
N-bromopropanamide
CID 15647963
N-methylpropanamide;propane
CID 91316585
4-N-methylbutanedihydrazide
CID 45122743

Frequently Asked Questions

What is the IUPAC name of azane;propanehydrazide;hydroiodide?
The IUPAC name of azane;propanehydrazide;hydroiodide (CID 174716911) is azane;propanehydrazide;hydroiodide.
What is the SMILES notation for azane;propanehydrazide;hydroiodide?
The canonical SMILES for azane;propanehydrazide;hydroiodide is CCC(=O)NN.I.N.
What is the InChIKey of azane;propanehydrazide;hydroiodide?
The InChIKey is SSGACDPDWPTBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2O.HI.H3N/c1-2-3(6)5-4;;/h2,4H2,1H3,(H,5,6);1H;1H3.
What are the key properties of azane;propanehydrazide;hydroiodide?
azane;propanehydrazide;hydroiodide has a molecular weight of 233.05 g/mol, XLogP of 0.17, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;propanehydrazide;hydroiodide is sourced from PubChem (CID 174716911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).