N'-(hydroxymethyl)acetohydrazide

C3H8N2O2 — CID 57436115

IUPACN'-(hydroxymethyl)acetohydrazide
SMILESCC(=O)NNCO
InChIInChI=1S/C3H8N2O2/c1-3(7)5-4-2-6/h4,6H,2H2,1H3,(H,5,7)
InChIKeyZFLSDAVSGWHBGC-UHFFFAOYSA-N
MW104.11 g/mol
LogP-1.42
Rot. Bonds2

About N'-(hydroxymethyl)acetohydrazide

N'-(hydroxymethyl)acetohydrazide (PubChem CID 57436115) has the molecular formula C3H8N2O2 and a molecular weight of 104.11 g/mol. Its IUPAC name is N'-(hydroxymethyl)acetohydrazide.

Molecular Properties

Compound NameN'-(hydroxymethyl)acetohydrazide
PubChem CID57436115
Molecular FormulaC3H8N2O2
Molecular Weight104.11 g/mol
Exact Mass104.06
IUPAC NameN'-(hydroxymethyl)acetohydrazide
SMILESCC(=O)NNCO
InChIInChI=1S/C3H8N2O2/c1-3(7)5-4-2-6/h4,6H,2H2,1H3,(H,5,7)
InChIKeyZFLSDAVSGWHBGC-UHFFFAOYSA-N
XLogP-1.42
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.11
LogP ≤ 5-1.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', '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 N'-(hydroxymethyl)acetohydrazide?
The IUPAC name of N'-(hydroxymethyl)acetohydrazide (CID 57436115) is N'-(hydroxymethyl)acetohydrazide.
What is the SMILES notation for N'-(hydroxymethyl)acetohydrazide?
The canonical SMILES for N'-(hydroxymethyl)acetohydrazide is CC(=O)NNCO.
What is the InChIKey of N'-(hydroxymethyl)acetohydrazide?
The InChIKey is ZFLSDAVSGWHBGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2O2/c1-3(7)5-4-2-6/h4,6H,2H2,1H3,(H,5,7).
What are the key properties of N'-(hydroxymethyl)acetohydrazide?
N'-(hydroxymethyl)acetohydrazide has a molecular weight of 104.11 g/mol, XLogP of -1.42, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(hydroxymethyl)acetohydrazide is sourced from PubChem (CID 57436115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).