4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one

C7H11N5O2 — CID 127013403

IUPAC4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one
SMILESO=C1CC(O)CN1CCn1ncnn1
InChIInChI=1S/C7H11N5O2/c13-6-3-7(14)11(4-6)1-2-12-9-5-8-10-12/h5-6,13H,1-4H2
InChIKeyOOAAVRCVNJRBSZ-UHFFFAOYSA-N
MW197.20 g/mol
LogP-1.73
Rot. Bonds3

About 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one

4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one (PubChem CID 127013403) has the molecular formula C7H11N5O2 and a molecular weight of 197.20 g/mol. Its IUPAC name is 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one
PubChem CID127013403
Molecular FormulaC7H11N5O2
Molecular Weight197.20 g/mol
Exact Mass197.09
IUPAC Name4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one
SMILESO=C1CC(O)CN1CCn1ncnn1
InChIInChI=1S/C7H11N5O2/c13-6-3-7(14)11(4-6)1-2-12-9-5-8-10-12/h5-6,13H,1-4H2
InChIKeyOOAAVRCVNJRBSZ-UHFFFAOYSA-N
XLogP-1.73
TPSA84.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 5-1.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one?
The IUPAC name of 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one (CID 127013403) is 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one.
What is the SMILES notation for 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one?
The canonical SMILES for 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one is O=C1CC(O)CN1CCn1ncnn1.
What is the InChIKey of 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one?
The InChIKey is OOAAVRCVNJRBSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5O2/c13-6-3-7(14)11(4-6)1-2-12-9-5-8-10-12/h5-6,13H,1-4H2.
What are the key properties of 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one?
4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one has a molecular weight of 197.20 g/mol, XLogP of -1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-[2-(tetrazol-2-yl)ethyl]pyrrolidin-2-one is sourced from PubChem (CID 127013403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).