(5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one

C7H11N5O2 — CID 134608069

IUPAC(5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one
SMILESNC(Cn1nccn1)[C@H]1CNC(=O)O1
InChIInChI=1S/C7H11N5O2/c8-5(4-12-10-1-2-11-12)6-3-9-7(13)14-6/h1-2,5-6H,3-4,8H2,(H,9,13)/t5?,6-/m1/s1
InChIKeyIPTXRVGOPUXVFN-PRJDIBJQSA-N
MW197.20 g/mol
LogP-1.29
Rot. Bonds3

About (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one

(5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one (PubChem CID 134608069) has the molecular formula C7H11N5O2 and a molecular weight of 197.20 g/mol. Its IUPAC name is (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one
PubChem CID134608069
Molecular FormulaC7H11N5O2
Molecular Weight197.20 g/mol
Exact Mass197.09
IUPAC Name(5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one
SMILESNC(Cn1nccn1)[C@H]1CNC(=O)O1
InChIInChI=1S/C7H11N5O2/c8-5(4-12-10-1-2-11-12)6-3-9-7(13)14-6/h1-2,5-6H,3-4,8H2,(H,9,13)/t5?,6-/m1/s1
InChIKeyIPTXRVGOPUXVFN-PRJDIBJQSA-N
XLogP-1.29
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 5-1.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one (CID 134608069) is (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one is NC(Cn1nccn1)[C@H]1CNC(=O)O1.
What is the InChIKey of (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one?
The InChIKey is IPTXRVGOPUXVFN-PRJDIBJQSA-N. The full InChI is InChI=1S/C7H11N5O2/c8-5(4-12-10-1-2-11-12)6-3-9-7(13)14-6/h1-2,5-6H,3-4,8H2,(H,9,13)/t5?,6-/m1/s1.
What are the key properties of (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one?
(5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one has a molecular weight of 197.20 g/mol, XLogP of -1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[1-amino-2-(triazol-2-yl)ethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 134608069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).