3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide

C11H18N2O4 — CID 142439186

IUPAC3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide
SMILESCN1OC(=O)C(C(=O)NC2(C)CCCC2)C1O
InChIInChI=1S/C11H18N2O4/c1-11(5-3-4-6-11)12-8(14)7-9(15)13(2)17-10(7)16/h7,9,15H,3-6H2,1-2H3,(H,12,14)
InChIKeyYMZBAVBOLDTLRN-UHFFFAOYSA-N
MW242.27 g/mol
LogP-0.23
Rot. Bonds2

About 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide

3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide (PubChem CID 142439186) has the molecular formula C11H18N2O4 and a molecular weight of 242.27 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide
PubChem CID142439186
Molecular FormulaC11H18N2O4
Molecular Weight242.27 g/mol
Exact Mass242.13
IUPAC Name3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide
SMILESCN1OC(=O)C(C(=O)NC2(C)CCCC2)C1O
InChIInChI=1S/C11H18N2O4/c1-11(5-3-4-6-11)12-8(14)7-9(15)13(2)17-10(7)16/h7,9,15H,3-6H2,1-2H3,(H,12,14)
InChIKeyYMZBAVBOLDTLRN-UHFFFAOYSA-N
XLogP-0.23
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

N-(1,2-dimethylcyclopropyl)-3-hydroxy-2-methyl-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439095
formic acid;3-hydroxy-N-(1-methylcyclohexyl)-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439100
3-hydroxy-N-(1-methylcyclohexyl)-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439101
N-(1-ethynylcyclohexyl)-3-hydroxy-2-methyl-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439103
Methyl 1-[(3-hydroxy-2-methyl-5-oxo-1,2-oxazolidine-4-carbonyl)amino]cyclopentane-1-carboxylate
CID 142439118
N-hexyl-3-hydroxy-2-methyl-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439127
3-hydroxy-2-methyl-N-(1-methylcyclobutyl)-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439138
3-hydroxy-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439159
N-(1-cyanocyclopentyl)-3-hydroxy-2-methyl-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439165
3-hydroxy-N-(3-methylhexyl)-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439183
N-(1-ethylcyclopropyl)-3-hydroxy-2-methyl-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439185
ethane;3-hydroxy-2-methyl-N-(1-methylcyclohexyl)-5-oxo-1,2-oxazolidine-4-carboxamide
CID 142439190

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide?
The IUPAC name of 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide (CID 142439186) is 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide?
The canonical SMILES for 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide is CN1OC(=O)C(C(=O)NC2(C)CCCC2)C1O.
What is the InChIKey of 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide?
The InChIKey is YMZBAVBOLDTLRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4/c1-11(5-3-4-6-11)12-8(14)7-9(15)13(2)17-10(7)16/h7,9,15H,3-6H2,1-2H3,(H,12,14).
What are the key properties of 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide?
3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide has a molecular weight of 242.27 g/mol, XLogP of -0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-N-(1-methylcyclopentyl)-5-oxo-1,2-oxazolidine-4-carboxamide is sourced from PubChem (CID 142439186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).