2-(5-aminotetrazol-1-yl)acetohydrazide

C3H7N7O — CID 16765167

IUPAC2-(5-aminotetrazol-1-yl)acetohydrazide
SMILESNNC(=O)Cn1nnnc1N
InChIInChI=1S/C3H7N7O/c4-3-7-8-9-10(3)1-2(11)6-5/h1,5H2,(H,6,11)(H2,4,7,9)
InChIKeyUMNZFAMPSUQUMO-UHFFFAOYSA-N
MW157.14 g/mol
LogP-2.75
Rot. Bonds2

About 2-(5-aminotetrazol-1-yl)acetohydrazide

2-(5-aminotetrazol-1-yl)acetohydrazide (PubChem CID 16765167) has the molecular formula C3H7N7O and a molecular weight of 157.14 g/mol. Its IUPAC name is 2-(5-aminotetrazol-1-yl)acetohydrazide.

Molecular Properties

Compound Name2-(5-aminotetrazol-1-yl)acetohydrazide
PubChem CID16765167
Molecular FormulaC3H7N7O
Molecular Weight157.14 g/mol
Exact Mass157.07
IUPAC Name2-(5-aminotetrazol-1-yl)acetohydrazide
SMILESNNC(=O)Cn1nnnc1N
InChIInChI=1S/C3H7N7O/c4-3-7-8-9-10(3)1-2(11)6-5/h1,5H2,(H,6,11)(H2,4,7,9)
InChIKeyUMNZFAMPSUQUMO-UHFFFAOYSA-N
XLogP-2.75
TPSA124.74 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.14
LogP ≤ 5-2.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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 2-(5-aminotetrazol-1-yl)acetohydrazide?
The IUPAC name of 2-(5-aminotetrazol-1-yl)acetohydrazide (CID 16765167) is 2-(5-aminotetrazol-1-yl)acetohydrazide.
What is the SMILES notation for 2-(5-aminotetrazol-1-yl)acetohydrazide?
The canonical SMILES for 2-(5-aminotetrazol-1-yl)acetohydrazide is NNC(=O)Cn1nnnc1N.
What is the InChIKey of 2-(5-aminotetrazol-1-yl)acetohydrazide?
The InChIKey is UMNZFAMPSUQUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N7O/c4-3-7-8-9-10(3)1-2(11)6-5/h1,5H2,(H,6,11)(H2,4,7,9).
What are the key properties of 2-(5-aminotetrazol-1-yl)acetohydrazide?
2-(5-aminotetrazol-1-yl)acetohydrazide has a molecular weight of 157.14 g/mol, XLogP of -2.75, 2 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-aminotetrazol-1-yl)acetohydrazide is sourced from PubChem (CID 16765167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).