N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide

C9H15N3O2 — CID 127011776

IUPACN'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide
SMILESN/C(=N\C1CONC1=O)C1CCCC1
InChIInChI=1S/C9H15N3O2/c10-8(6-3-1-2-4-6)11-7-5-14-12-9(7)13/h6-7H,1-5H2,(H2,10,11)(H,12,13)
InChIKeyCPIHRNWTGYMBDJ-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.04
Rot. Bonds2

About N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide

N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide (PubChem CID 127011776) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide.

Molecular Properties

Compound NameN'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide
PubChem CID127011776
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC NameN'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide
SMILESN/C(=N\C1CONC1=O)C1CCCC1
InChIInChI=1S/C9H15N3O2/c10-8(6-3-1-2-4-6)11-7-5-14-12-9(7)13/h6-7H,1-5H2,(H2,10,11)(H,12,13)
InChIKeyCPIHRNWTGYMBDJ-UHFFFAOYSA-N
XLogP-0.04
TPSA76.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide?
The IUPAC name of N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide (CID 127011776) is N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide.
What is the SMILES notation for N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide?
The canonical SMILES for N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide is N/C(=N\C1CONC1=O)C1CCCC1.
What is the InChIKey of N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide?
The InChIKey is CPIHRNWTGYMBDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c10-8(6-3-1-2-4-6)11-7-5-14-12-9(7)13/h6-7H,1-5H2,(H2,10,11)(H,12,13).
What are the key properties of N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide?
N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide has a molecular weight of 197.24 g/mol, XLogP of -0.04, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-oxo-1,2-oxazolidin-4-yl)cyclopentanecarboximidamide is sourced from PubChem (CID 127011776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).