2-phenoxy-N-(2H-tetrazol-5-yl)acetamide

C9H9N5O2 — CID 874260

IUPAC2-phenoxy-N-(2H-tetrazol-5-yl)acetamide
SMILESO=C(COc1ccccc1)Nc1nn[nH]n1
InChIInChI=1S/C9H9N5O2/c15-8(10-9-11-13-14-12-9)6-16-7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,11,12,13,14,15)
InChIKeyUERKZKRAKIIJOK-UHFFFAOYSA-N
MW219.20 g/mol
LogP0.22
Rot. Bonds4

About 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide

2-phenoxy-N-(2H-tetrazol-5-yl)acetamide (PubChem CID 874260) has the molecular formula C9H9N5O2 and a molecular weight of 219.20 g/mol. Its IUPAC name is 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-phenoxy-N-(2H-tetrazol-5-yl)acetamide
PubChem CID874260
Molecular FormulaC9H9N5O2
Molecular Weight219.20 g/mol
Exact Mass219.08
IUPAC Name2-phenoxy-N-(2H-tetrazol-5-yl)acetamide
SMILESO=C(COc1ccccc1)Nc1nn[nH]n1
InChIInChI=1S/C9H9N5O2/c15-8(10-9-11-13-14-12-9)6-16-7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,11,12,13,14,15)
InChIKeyUERKZKRAKIIJOK-UHFFFAOYSA-N
XLogP0.22
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-Phenoxy-N-(4H-[1,2,4]triazol-3-yl)-acetamide
CID 555301
2-phenoxy-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
CID 2102404
2-(4-ethylphenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 893388
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-phenoxyacetamide
CID 2852882
2-(2,4-Dimethyl-phenoxy)-N-(2-methyl-2H-tetrazol-5-yl)-acetamide
CID 654531
2-(4-chlorophenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 648464
2-(4-chlorophenoxy)-2-methyl-N-(2H-tetrazol-5-yl)propanamide
CID 71624133
N-(2-methyl-2H-1,2,3,4-tetrazol-5-yl)-2-(4-methylphenoxy)acetamide
CID 953388
N-(2-ethyl-2H-tetrazol-5-yl)-2-phenoxyacetamide
CID 953085
2-phenoxy-N-(2-propyl(1,2,3,4-tetraazol-5-yl))acetamide
CID 954295
N-(2-methyl-2H-tetrazol-5-yl)-2-phenoxyacetamide
CID 1087156
2-phenoxy-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 4217877

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide?
The IUPAC name of 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide (CID 874260) is 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide.
What is the SMILES notation for 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide?
The canonical SMILES for 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide is O=C(COc1ccccc1)Nc1nn[nH]n1.
What is the InChIKey of 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide?
The InChIKey is UERKZKRAKIIJOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5O2/c15-8(10-9-11-13-14-12-9)6-16-7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,11,12,13,14,15).
What are the key properties of 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide?
2-phenoxy-N-(2H-tetrazol-5-yl)acetamide has a molecular weight of 219.20 g/mol, XLogP of 0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-(2H-tetrazol-5-yl)acetamide is sourced from PubChem (CID 874260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).