2-amino-1-(2-ethyltetrazol-5-yl)ethanone

C5H9N5O — CID 84763572

IUPAC2-amino-1-(2-ethyltetrazol-5-yl)ethanone
SMILESCCn1nnc(C(=O)CN)n1
InChIInChI=1S/C5H9N5O/c1-2-10-8-5(7-9-10)4(11)3-6/h2-3,6H2,1H3
InChIKeyQXWXQQBDICJTEU-UHFFFAOYSA-N
MW155.16 g/mol
LogP-1.17
Rot. Bonds3

About 2-amino-1-(2-ethyltetrazol-5-yl)ethanone

2-amino-1-(2-ethyltetrazol-5-yl)ethanone (PubChem CID 84763572) has the molecular formula C5H9N5O and a molecular weight of 155.16 g/mol. Its IUPAC name is 2-amino-1-(2-ethyltetrazol-5-yl)ethanone.

Molecular Properties

Compound Name2-amino-1-(2-ethyltetrazol-5-yl)ethanone
PubChem CID84763572
Molecular FormulaC5H9N5O
Molecular Weight155.16 g/mol
Exact Mass155.08
IUPAC Name2-amino-1-(2-ethyltetrazol-5-yl)ethanone
SMILESCCn1nnc(C(=O)CN)n1
InChIInChI=1S/C5H9N5O/c1-2-10-8-5(7-9-10)4(11)3-6/h2-3,6H2,1H3
InChIKeyQXWXQQBDICJTEU-UHFFFAOYSA-N
XLogP-1.17
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-1.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-ethyltetrazol-5-yl)ethanone?
The IUPAC name of 2-amino-1-(2-ethyltetrazol-5-yl)ethanone (CID 84763572) is 2-amino-1-(2-ethyltetrazol-5-yl)ethanone.
What is the SMILES notation for 2-amino-1-(2-ethyltetrazol-5-yl)ethanone?
The canonical SMILES for 2-amino-1-(2-ethyltetrazol-5-yl)ethanone is CCn1nnc(C(=O)CN)n1.
What is the InChIKey of 2-amino-1-(2-ethyltetrazol-5-yl)ethanone?
The InChIKey is QXWXQQBDICJTEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N5O/c1-2-10-8-5(7-9-10)4(11)3-6/h2-3,6H2,1H3.
What are the key properties of 2-amino-1-(2-ethyltetrazol-5-yl)ethanone?
2-amino-1-(2-ethyltetrazol-5-yl)ethanone has a molecular weight of 155.16 g/mol, XLogP of -1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-ethyltetrazol-5-yl)ethanone is sourced from PubChem (CID 84763572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).