2-(5-methyltetrazol-1-yl)acetamide

C4H7N5O — CID 71946280

IUPAC2-(5-methyltetrazol-1-yl)acetamide
SMILESCc1nnnn1CC(N)=O
InChIInChI=1S/C4H7N5O/c1-3-6-7-8-9(3)2-4(5)10/h2H2,1H3,(H2,5,10)
InChIKeyBBFNQHUFRJQDEA-UHFFFAOYSA-N
MW141.13 g/mol
LogP-1.53
Rot. Bonds2

About 2-(5-methyltetrazol-1-yl)acetamide

2-(5-methyltetrazol-1-yl)acetamide (PubChem CID 71946280) has the molecular formula C4H7N5O and a molecular weight of 141.13 g/mol. Its IUPAC name is 2-(5-methyltetrazol-1-yl)acetamide.

Molecular Properties

Compound Name2-(5-methyltetrazol-1-yl)acetamide
PubChem CID71946280
Molecular FormulaC4H7N5O
Molecular Weight141.13 g/mol
Exact Mass141.07
IUPAC Name2-(5-methyltetrazol-1-yl)acetamide
SMILESCc1nnnn1CC(N)=O
InChIInChI=1S/C4H7N5O/c1-3-6-7-8-9(3)2-4(5)10/h2H2,1H3,(H2,5,10)
InChIKeyBBFNQHUFRJQDEA-UHFFFAOYSA-N
XLogP-1.53
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.13
LogP ≤ 5-1.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyltetrazol-1-yl)acetamide?
The IUPAC name of 2-(5-methyltetrazol-1-yl)acetamide (CID 71946280) is 2-(5-methyltetrazol-1-yl)acetamide.
What is the SMILES notation for 2-(5-methyltetrazol-1-yl)acetamide?
The canonical SMILES for 2-(5-methyltetrazol-1-yl)acetamide is Cc1nnnn1CC(N)=O.
What is the InChIKey of 2-(5-methyltetrazol-1-yl)acetamide?
The InChIKey is BBFNQHUFRJQDEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N5O/c1-3-6-7-8-9(3)2-4(5)10/h2H2,1H3,(H2,5,10).
What are the key properties of 2-(5-methyltetrazol-1-yl)acetamide?
2-(5-methyltetrazol-1-yl)acetamide has a molecular weight of 141.13 g/mol, XLogP of -1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyltetrazol-1-yl)acetamide is sourced from PubChem (CID 71946280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).