3-(2-methyltetrazol-5-yl)-1,2-oxazole

C5H5N5O — CID 90705230

IUPAC3-(2-methyltetrazol-5-yl)-1,2-oxazole
SMILESCn1nnc(-c2ccon2)n1
InChIInChI=1S/C5H5N5O/c1-10-7-5(6-9-10)4-2-3-11-8-4/h2-3H,1H3
InChIKeyKFBCIRXHTWIVBQ-UHFFFAOYSA-N
MW151.13 g/mol
LogP-0.13
Rot. Bonds1

About 3-(2-methyltetrazol-5-yl)-1,2-oxazole

3-(2-methyltetrazol-5-yl)-1,2-oxazole (PubChem CID 90705230) has the molecular formula C5H5N5O and a molecular weight of 151.13 g/mol. Its IUPAC name is 3-(2-methyltetrazol-5-yl)-1,2-oxazole.

Molecular Properties

Compound Name3-(2-methyltetrazol-5-yl)-1,2-oxazole
PubChem CID90705230
Molecular FormulaC5H5N5O
Molecular Weight151.13 g/mol
Exact Mass151.05
IUPAC Name3-(2-methyltetrazol-5-yl)-1,2-oxazole
SMILESCn1nnc(-c2ccon2)n1
InChIInChI=1S/C5H5N5O/c1-10-7-5(6-9-10)4-2-3-11-8-4/h2-3H,1H3
InChIKeyKFBCIRXHTWIVBQ-UHFFFAOYSA-N
XLogP-0.13
TPSA69.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.13
LogP ≤ 5-0.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methyltetrazol-5-yl)-1,2-oxazole?
The IUPAC name of 3-(2-methyltetrazol-5-yl)-1,2-oxazole (CID 90705230) is 3-(2-methyltetrazol-5-yl)-1,2-oxazole.
What is the SMILES notation for 3-(2-methyltetrazol-5-yl)-1,2-oxazole?
The canonical SMILES for 3-(2-methyltetrazol-5-yl)-1,2-oxazole is Cn1nnc(-c2ccon2)n1.
What is the InChIKey of 3-(2-methyltetrazol-5-yl)-1,2-oxazole?
The InChIKey is KFBCIRXHTWIVBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N5O/c1-10-7-5(6-9-10)4-2-3-11-8-4/h2-3H,1H3.
What are the key properties of 3-(2-methyltetrazol-5-yl)-1,2-oxazole?
3-(2-methyltetrazol-5-yl)-1,2-oxazole has a molecular weight of 151.13 g/mol, XLogP of -0.13, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyltetrazol-5-yl)-1,2-oxazole is sourced from PubChem (CID 90705230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).