N'-acetyl-3-aminopropanehydrazide

C5H11N3O2 — CID 55285042

IUPACN'-acetyl-3-aminopropanehydrazide
SMILESCC(=O)NNC(=O)CCN
InChIInChI=1S/C5H11N3O2/c1-4(9)7-8-5(10)2-3-6/h2-3,6H2,1H3,(H,7,9)(H,8,10)
InChIKeyIVFNKGZMRFDXDE-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.50
Rot. Bonds2

About N'-acetyl-3-aminopropanehydrazide

N'-acetyl-3-aminopropanehydrazide (PubChem CID 55285042) has the molecular formula C5H11N3O2 and a molecular weight of 145.16 g/mol. Its IUPAC name is N'-acetyl-3-aminopropanehydrazide.

Molecular Properties

Compound NameN'-acetyl-3-aminopropanehydrazide
PubChem CID55285042
Molecular FormulaC5H11N3O2
Molecular Weight145.16 g/mol
Exact Mass145.09
IUPAC NameN'-acetyl-3-aminopropanehydrazide
SMILESCC(=O)NNC(=O)CCN
InChIInChI=1S/C5H11N3O2/c1-4(9)7-8-5(10)2-3-6/h2-3,6H2,1H3,(H,7,9)(H,8,10)
InChIKeyIVFNKGZMRFDXDE-UHFFFAOYSA-N
XLogP-1.50
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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'-acetyl-3-aminopropanehydrazide?
The IUPAC name of N'-acetyl-3-aminopropanehydrazide (CID 55285042) is N'-acetyl-3-aminopropanehydrazide.
What is the SMILES notation for N'-acetyl-3-aminopropanehydrazide?
The canonical SMILES for N'-acetyl-3-aminopropanehydrazide is CC(=O)NNC(=O)CCN.
What is the InChIKey of N'-acetyl-3-aminopropanehydrazide?
The InChIKey is IVFNKGZMRFDXDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O2/c1-4(9)7-8-5(10)2-3-6/h2-3,6H2,1H3,(H,7,9)(H,8,10).
What are the key properties of N'-acetyl-3-aminopropanehydrazide?
N'-acetyl-3-aminopropanehydrazide has a molecular weight of 145.16 g/mol, XLogP of -1.50, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-3-aminopropanehydrazide is sourced from PubChem (CID 55285042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).