N'-ethylpropanehydrazide

C5H12N2O — CID 19821575

IUPACN'-ethylpropanehydrazide
SMILESCCNNC(=O)CC
InChIInChI=1S/C5H12N2O/c1-3-5(8)7-6-4-2/h6H,3-4H2,1-2H3,(H,7,8)
InChIKeyNQUUVCNFMOESGT-UHFFFAOYSA-N
MW116.16 g/mol
LogP0.04
Rot. Bonds3

About N'-ethylpropanehydrazide

N'-ethylpropanehydrazide (PubChem CID 19821575) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is N'-ethylpropanehydrazide.

Molecular Properties

Compound NameN'-ethylpropanehydrazide
PubChem CID19821575
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC NameN'-ethylpropanehydrazide
SMILESCCNNC(=O)CC
InChIInChI=1S/C5H12N2O/c1-3-5(8)7-6-4-2/h6H,3-4H2,1-2H3,(H,7,8)
InChIKeyNQUUVCNFMOESGT-UHFFFAOYSA-N
XLogP0.04
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-ethylpropanehydrazide?
The IUPAC name of N'-ethylpropanehydrazide (CID 19821575) is N'-ethylpropanehydrazide.
What is the SMILES notation for N'-ethylpropanehydrazide?
The canonical SMILES for N'-ethylpropanehydrazide is CCNNC(=O)CC.
What is the InChIKey of N'-ethylpropanehydrazide?
The InChIKey is NQUUVCNFMOESGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c1-3-5(8)7-6-4-2/h6H,3-4H2,1-2H3,(H,7,8).
What are the key properties of N'-ethylpropanehydrazide?
N'-ethylpropanehydrazide has a molecular weight of 116.16 g/mol, XLogP of 0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethylpropanehydrazide is sourced from PubChem (CID 19821575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).