(5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one

C8H12N4O2 — CID 135132907

IUPAC(5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one
SMILESN[C@H](Cn1cccn1)[C@H]1CNC(=O)O1
InChIInChI=1S/C8H12N4O2/c9-6(5-12-3-1-2-11-12)7-4-10-8(13)14-7/h1-3,6-7H,4-5,9H2,(H,10,13)/t6-,7-/m1/s1
InChIKeyUUQBLCZIWHAMMT-RNFRBKRXSA-N
MW196.21 g/mol
LogP-0.68
Rot. Bonds3

About (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one

(5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one (PubChem CID 135132907) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one
PubChem CID135132907
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name(5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one
SMILESN[C@H](Cn1cccn1)[C@H]1CNC(=O)O1
InChIInChI=1S/C8H12N4O2/c9-6(5-12-3-1-2-11-12)7-4-10-8(13)14-7/h1-3,6-7H,4-5,9H2,(H,10,13)/t6-,7-/m1/s1
InChIKeyUUQBLCZIWHAMMT-RNFRBKRXSA-N
XLogP-0.68
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-0.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one (CID 135132907) is (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one is N[C@H](Cn1cccn1)[C@H]1CNC(=O)O1.
What is the InChIKey of (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one?
The InChIKey is UUQBLCZIWHAMMT-RNFRBKRXSA-N. The full InChI is InChI=1S/C8H12N4O2/c9-6(5-12-3-1-2-11-12)7-4-10-8(13)14-7/h1-3,6-7H,4-5,9H2,(H,10,13)/t6-,7-/m1/s1.
What are the key properties of (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one?
(5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one has a molecular weight of 196.21 g/mol, XLogP of -0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[(1R)-1-amino-2-pyrazol-1-ylethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 135132907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).