3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one

C6H9N5O2 — CID 139176254

IUPAC3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1CCn1cnnn1
InChIInChI=1S/C6H9N5O2/c12-6-10(3-4-13-6)1-2-11-5-7-8-9-11/h5H,1-4H2
InChIKeyRRPKJUTUTITBHZ-UHFFFAOYSA-N
MW183.17 g/mol
LogP-0.87
Rot. Bonds3

About 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one

3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one (PubChem CID 139176254) has the molecular formula C6H9N5O2 and a molecular weight of 183.17 g/mol. Its IUPAC name is 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one
PubChem CID139176254
Molecular FormulaC6H9N5O2
Molecular Weight183.17 g/mol
Exact Mass183.08
IUPAC Name3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1CCn1cnnn1
InChIInChI=1S/C6H9N5O2/c12-6-10(3-4-13-6)1-2-11-5-7-8-9-11/h5H,1-4H2
InChIKeyRRPKJUTUTITBHZ-UHFFFAOYSA-N
XLogP-0.87
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 5-0.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[2-(4-amino-3-methylpyrazol-1-yl)ethyl]-1,3-oxazolidin-2-one
CID 165479404
3-(2-ethylsulfanylethyl)-1,3-oxazolidin-2-one
CID 130297937
3-(2-iodoethyl)-1,3-oxazolidin-2-one
CID 575068
3-(2-bromoethyl)-1,3-oxazolidin-2-one
CID 22757234
3-octadecyl-1,3-oxazolidin-2-one
CID 59720965
3-octyl-1,3-oxazolidin-2-one
CID 3565999
3-[(4-ethyltriazol-1-yl)methyl]-1,3-oxazolidin-2-one
CID 141077351
3-[2-(5-aminopyrimidin-2-yl)ethyl]-1,3-oxazolidin-2-one
CID 105461568
3-[3-(5-phenyltetrazol-2-yl)propyl]-1,3-oxazolidin-2-one
CID 47772331
2-hydroxy-4-(2-oxo-1,3-oxazolidin-3-yl)butanoic acid
CID 107836616
3-[2-[1-(4-methylphenyl)tetrazol-5-yl]sulfanylethyl]-1,3-oxazolidin-2-one
CID 36563987
3-(aminomethyl)-1,3-oxazolidin-2-one;hydrochloride
CID 141105157

Frequently Asked Questions

What is the IUPAC name of 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one (CID 139176254) is 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one is O=C1OCCN1CCn1cnnn1.
What is the InChIKey of 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one?
The InChIKey is RRPKJUTUTITBHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N5O2/c12-6-10(3-4-13-6)1-2-11-5-7-8-9-11/h5H,1-4H2.
What are the key properties of 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one?
3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one has a molecular weight of 183.17 g/mol, XLogP of -0.87, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(tetrazol-1-yl)ethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 139176254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).