2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide

C4H6N4O2 — CID 83768266

IUPAC2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide
SMILESO=C(CO)Nc1ncn[nH]1
InChIInChI=1S/C4H6N4O2/c9-1-3(10)7-4-5-2-6-8-4/h2,9H,1H2,(H2,5,6,7,8,10)
InChIKeyIUIOYWGCCYCOMS-UHFFFAOYSA-N
MW142.12 g/mol
LogP-1.26
Rot. Bonds2

About 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide

2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide (PubChem CID 83768266) has the molecular formula C4H6N4O2 and a molecular weight of 142.12 g/mol. Its IUPAC name is 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide.

Molecular Properties

Compound Name2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide
PubChem CID83768266
Molecular FormulaC4H6N4O2
Molecular Weight142.12 g/mol
Exact Mass142.05
IUPAC Name2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide
SMILESO=C(CO)Nc1ncn[nH]1
InChIInChI=1S/C4H6N4O2/c9-1-3(10)7-4-5-2-6-8-4/h2,9H,1H2,(H2,5,6,7,8,10)
InChIKeyIUIOYWGCCYCOMS-UHFFFAOYSA-N
XLogP-1.26
TPSA90.90 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.12
LogP ≤ 5-1.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
The IUPAC name of 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide (CID 83768266) is 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide.
What is the SMILES notation for 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
The canonical SMILES for 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide is O=C(CO)Nc1ncn[nH]1.
What is the InChIKey of 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
The InChIKey is IUIOYWGCCYCOMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N4O2/c9-1-3(10)7-4-5-2-6-8-4/h2,9H,1H2,(H2,5,6,7,8,10).
What are the key properties of 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide has a molecular weight of 142.12 g/mol, XLogP of -1.26, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(1H-1,2,4-triazol-5-yl)acetamide is sourced from PubChem (CID 83768266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).