3-amino-2-methoxypropanehydrazide

C4H11N3O2 — CID 106112921

IUPAC3-amino-2-methoxypropanehydrazide
SMILESCOC(CN)C(=O)NN
InChIInChI=1S/C4H11N3O2/c1-9-3(2-5)4(8)7-6/h3H,2,5-6H2,1H3,(H,7,8)
InChIKeyHGJTXPZAKIPADP-UHFFFAOYSA-N
MW133.15 g/mol
LogP-2.05
Rot. Bonds3

About 3-amino-2-methoxypropanehydrazide

3-amino-2-methoxypropanehydrazide (PubChem CID 106112921) has the molecular formula C4H11N3O2 and a molecular weight of 133.15 g/mol. Its IUPAC name is 3-amino-2-methoxypropanehydrazide.

Molecular Properties

Compound Name3-amino-2-methoxypropanehydrazide
PubChem CID106112921
Molecular FormulaC4H11N3O2
Molecular Weight133.15 g/mol
Exact Mass133.09
IUPAC Name3-amino-2-methoxypropanehydrazide
SMILESCOC(CN)C(=O)NN
InChIInChI=1S/C4H11N3O2/c1-9-3(2-5)4(8)7-6/h3H,2,5-6H2,1H3,(H,7,8)
InChIKeyHGJTXPZAKIPADP-UHFFFAOYSA-N
XLogP-2.05
TPSA90.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-2.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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 3-amino-2-methoxypropanehydrazide?
The IUPAC name of 3-amino-2-methoxypropanehydrazide (CID 106112921) is 3-amino-2-methoxypropanehydrazide.
What is the SMILES notation for 3-amino-2-methoxypropanehydrazide?
The canonical SMILES for 3-amino-2-methoxypropanehydrazide is COC(CN)C(=O)NN.
What is the InChIKey of 3-amino-2-methoxypropanehydrazide?
The InChIKey is HGJTXPZAKIPADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3O2/c1-9-3(2-5)4(8)7-6/h3H,2,5-6H2,1H3,(H,7,8).
What are the key properties of 3-amino-2-methoxypropanehydrazide?
3-amino-2-methoxypropanehydrazide has a molecular weight of 133.15 g/mol, XLogP of -2.05, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methoxypropanehydrazide is sourced from PubChem (CID 106112921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).