cyclobutanecarbohydrazide

C5H10N2O — CID 969366

IUPACcyclobutanecarbohydrazide
SMILESNNC(=O)C1CCC1
InChIInChI=1S/C5H10N2O/c6-7-5(8)4-2-1-3-4/h4H,1-3,6H2,(H,7,8)
InChIKeyKYUUPPKLZSVGMG-UHFFFAOYSA-N
MW114.15 g/mol
LogP-0.22
Rot. Bonds1

About cyclobutanecarbohydrazide

cyclobutanecarbohydrazide (PubChem CID 969366) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is cyclobutanecarbohydrazide.

Molecular Properties

Compound Namecyclobutanecarbohydrazide
PubChem CID969366
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Namecyclobutanecarbohydrazide
SMILESNNC(=O)C1CCC1
InChIInChI=1S/C5H10N2O/c6-7-5(8)4-2-1-3-4/h4H,1-3,6H2,(H,7,8)
InChIKeyKYUUPPKLZSVGMG-UHFFFAOYSA-N
XLogP-0.22
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 cyclobutanecarbohydrazide?
The IUPAC name of cyclobutanecarbohydrazide (CID 969366) is cyclobutanecarbohydrazide.
What is the SMILES notation for cyclobutanecarbohydrazide?
The canonical SMILES for cyclobutanecarbohydrazide is NNC(=O)C1CCC1.
What is the InChIKey of cyclobutanecarbohydrazide?
The InChIKey is KYUUPPKLZSVGMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c6-7-5(8)4-2-1-3-4/h4H,1-3,6H2,(H,7,8).
What are the key properties of cyclobutanecarbohydrazide?
cyclobutanecarbohydrazide has a molecular weight of 114.15 g/mol, XLogP of -0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutanecarbohydrazide is sourced from PubChem (CID 969366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).