2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid

C11H18N2O4 — CID 115102549

IUPAC2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid
SMILESO=C(O)C1COC(=O)N1CCN1CCCCC1
InChIInChI=1S/C11H18N2O4/c14-10(15)9-8-17-11(16)13(9)7-6-12-4-2-1-3-5-12/h9H,1-8H2,(H,14,15)
InChIKeyMOIAVZFNDCTOLP-UHFFFAOYSA-N
MW242.27 g/mol
LogP0.38
Rot. Bonds4

About 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid

2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid (PubChem CID 115102549) has the molecular formula C11H18N2O4 and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid.

Molecular Properties

Compound Name2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid
PubChem CID115102549
Molecular FormulaC11H18N2O4
Molecular Weight242.27 g/mol
Exact Mass242.13
IUPAC Name2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid
SMILESO=C(O)C1COC(=O)N1CCN1CCCCC1
InChIInChI=1S/C11H18N2O4/c14-10(15)9-8-17-11(16)13(9)7-6-12-4-2-1-3-5-12/h9H,1-8H2,(H,14,15)
InChIKeyMOIAVZFNDCTOLP-UHFFFAOYSA-N
XLogP0.38
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-hydroxypropyl)-2-oxo-1,3-oxazolidine-4-carboxylic acid
CID 115102311
2-oxo-3-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1,3-oxazolidine-4-carboxylic acid
CID 115102469
2-oxo-3-(thian-2-ylmethyl)-1,3-oxazolidine-4-carboxylic acid
CID 115102486
2,4-dimethyl-6-oxo-1-(2-piperidin-1-ylethyl)piperidine-3-carboxylic acid
CID 62303069
(3R)-5-oxo-1-(2-piperidin-1-ylethyl)pyrrolidine-3-carboxylic acid
CID 29136485
(4S)-3-(cyclohexylmethyl)-N-(3-morpholin-4-ylpropyl)-2-oxo-1,3-oxazolidine-4-carboxamide
CID 50851783
(4S)-3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-oxazolidine-4-carboxylic acid
CID 96663913
1-(2-piperidin-1-ylethyl)pyrrolidine-2,5-dione
CID 141389881
3-oxo-2-(2-pyrrolidin-1-ylethyl)-1,4-dihydroisoquinoline-1-carboxylic acid
CID 134336892
4-[2-piperidin-1-ylethyl(propyl)amino]oxolane-3-carboxylic acid
CID 66254024
3-methyl-2-oxo-1,3-oxazinane-5-carboxylic acid
CID 83845755
1-(2-pyrrolidin-1-ylethyl)pyrrolidine
CID 11062806

Frequently Asked Questions

What is the IUPAC name of 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid?
The IUPAC name of 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid (CID 115102549) is 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid.
What is the SMILES notation for 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid?
The canonical SMILES for 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid is O=C(O)C1COC(=O)N1CCN1CCCCC1.
What is the InChIKey of 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid?
The InChIKey is MOIAVZFNDCTOLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4/c14-10(15)9-8-17-11(16)13(9)7-6-12-4-2-1-3-5-12/h9H,1-8H2,(H,14,15).
What are the key properties of 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid?
2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid has a molecular weight of 242.27 g/mol, XLogP of 0.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid is sourced from PubChem (CID 115102549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).