2-(5H-tetrazol-5-yl)-1,3-oxazolidine

C4H7N5O — CID 175563681

IUPAC2-(5H-tetrazol-5-yl)-1,3-oxazolidine
SMILESC1COC(C2N=NN=N2)N1
InChIInChI=1S/C4H7N5O/c1-2-10-4(5-1)3-6-8-9-7-3/h3-5H,1-2H2
InChIKeySCMXMCLUUKTOCT-UHFFFAOYSA-N
MW141.13 g/mol
LogP0.09
Rot. Bonds1

About 2-(5H-tetrazol-5-yl)-1,3-oxazolidine

2-(5H-tetrazol-5-yl)-1,3-oxazolidine (PubChem CID 175563681) has the molecular formula C4H7N5O and a molecular weight of 141.13 g/mol. Its IUPAC name is 2-(5H-tetrazol-5-yl)-1,3-oxazolidine.

Molecular Properties

Compound Name2-(5H-tetrazol-5-yl)-1,3-oxazolidine
PubChem CID175563681
Molecular FormulaC4H7N5O
Molecular Weight141.13 g/mol
Exact Mass141.07
IUPAC Name2-(5H-tetrazol-5-yl)-1,3-oxazolidine
SMILESC1COC(C2N=NN=N2)N1
InChIInChI=1S/C4H7N5O/c1-2-10-4(5-1)3-6-8-9-7-3/h3-5H,1-2H2
InChIKeySCMXMCLUUKTOCT-UHFFFAOYSA-N
XLogP0.09
TPSA70.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.13
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-cyclohexyl-1,3-oxazolidine
CID 117225833
(3S)-3-(5H-tetrazol-5-yl)morpholine
CID 129389237
2-(azepan-2-yl)-1,3-oxazolidine
CID 174654499
2-(oxan-4-yl)-1,3-oxazolidine;hydrochloride
CID 117225611
2-cycloheptyl-1,3-oxazepane
CID 175475084
2-(oxolan-3-yl)-1,3-oxazolidine;hydrochloride
CID 117225597
2-(thiolan-2-yl)-1,3-oxazolidine
CID 117225672
2-(1-methylpiperidin-3-yl)-1,3-oxazolidine
CID 117225662
2-(1-ethylpiperidin-3-yl)-1,3-oxazolidine
CID 117225664
2-(1-methylpyrrolidin-3-yl)-1,3-oxazolidine;hydrochloride
CID 117225605
2-(1,3,5-triazin-2-yl)-1,3-oxazolidine
CID 54061386
(2R)-2-pyridin-4-yl-1,3-oxazolidine
CID 94252095

Frequently Asked Questions

What is the IUPAC name of 2-(5H-tetrazol-5-yl)-1,3-oxazolidine?
The IUPAC name of 2-(5H-tetrazol-5-yl)-1,3-oxazolidine (CID 175563681) is 2-(5H-tetrazol-5-yl)-1,3-oxazolidine.
What is the SMILES notation for 2-(5H-tetrazol-5-yl)-1,3-oxazolidine?
The canonical SMILES for 2-(5H-tetrazol-5-yl)-1,3-oxazolidine is C1COC(C2N=NN=N2)N1.
What is the InChIKey of 2-(5H-tetrazol-5-yl)-1,3-oxazolidine?
The InChIKey is SCMXMCLUUKTOCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N5O/c1-2-10-4(5-1)3-6-8-9-7-3/h3-5H,1-2H2.
What are the key properties of 2-(5H-tetrazol-5-yl)-1,3-oxazolidine?
2-(5H-tetrazol-5-yl)-1,3-oxazolidine has a molecular weight of 141.13 g/mol, XLogP of 0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5H-tetrazol-5-yl)-1,3-oxazolidine is sourced from PubChem (CID 175563681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).