[(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate

C17H20N2O5 — CID 99793751

IUPAC[(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate
SMILESO=C1NC[C@H](COC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)O1
InChIInChI=1S/C17H20N2O5/c20-15(12-5-2-1-3-6-12)19-8-4-7-13(10-19)16(21)23-11-14-9-18-17(22)24-14/h1-3,5-6,13-14H,4,7-11H2,(H,18,22)/t13-,14-/m1/s1
InChIKeyKXPXKKWMNWQWTP-ZIAGYGMSSA-N
MW332.36 g/mol
LogP1.19
Rot. Bonds4

About [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate

[(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate (PubChem CID 99793751) has the molecular formula C17H20N2O5 and a molecular weight of 332.36 g/mol. Its IUPAC name is [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate.

Molecular Properties

Compound Name[(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate
PubChem CID99793751
Molecular FormulaC17H20N2O5
Molecular Weight332.36 g/mol
Exact Mass332.14
IUPAC Name[(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate
SMILESO=C1NC[C@H](COC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)O1
InChIInChI=1S/C17H20N2O5/c20-15(12-5-2-1-3-6-12)19-8-4-7-13(10-19)16(21)23-11-14-9-18-17(22)24-14/h1-3,5-6,13-14H,4,7-11H2,(H,18,22)/t13-,14-/m1/s1
InChIKeyKXPXKKWMNWQWTP-ZIAGYGMSSA-N
XLogP1.19
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate with MolForge

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Launch Full Analysis

Related Compounds

propyl 1-benzoylpiperidine-3-carboxylate
CID 57315331
ethyl (3R)-1-(4-benzoylbenzoyl)piperidine-3-carboxylate
CID 30283825
(4-benzylmorpholin-2-yl)methyl 1-(4-fluorobenzoyl)piperidine-3-carboxylate
CID 78832355
ethyl (3R)-1-(pyridine-4-carbonyl)piperidine-3-carboxylate
CID 81344217
1-benzoylpiperidine-3-carbonyl chloride
CID 15718173
ethyl 1-[4-(phenylcarbamoylamino)benzoyl]piperidine-3-carboxylate
CID 51250741
1-benzoyl-N-pyrrolidin-3-ylpiperidine-3-carboxamide;hydrochloride
CID 119453805
ethyl (3S)-1-[(2-oxo-1,3-oxazolidin-5-yl)methyl]piperidine-3-carboxylate
CID 113330833
ethyl (3S)-1-(2-methylbenzoyl)piperidine-3-carboxylate
CID 81345354
(5-phenyl-1,2-oxazol-3-yl)methyl 1-(4-fluorobenzoyl)piperidine-3-carboxylate
CID 55459448
ethyl (3S)-1-(naphthalene-2-carbonyl)piperidine-3-carboxylate
CID 26710230
ethyl 1-(6-oxo-1-phenylpyridine-3-carbonyl)piperidine-3-carboxylate
CID 91954923

Frequently Asked Questions

What is the IUPAC name of [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate?
The IUPAC name of [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate (CID 99793751) is [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate.
What is the SMILES notation for [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate?
The canonical SMILES for [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate is O=C1NC[C@H](COC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)O1.
What is the InChIKey of [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate?
The InChIKey is KXPXKKWMNWQWTP-ZIAGYGMSSA-N. The full InChI is InChI=1S/C17H20N2O5/c20-15(12-5-2-1-3-6-12)19-8-4-7-13(10-19)16(21)23-11-14-9-18-17(22)24-14/h1-3,5-6,13-14H,4,7-11H2,(H,18,22)/t13-,14-/m1/s1.
What are the key properties of [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate?
[(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate has a molecular weight of 332.36 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl (3R)-1-benzoylpiperidine-3-carboxylate is sourced from PubChem (CID 99793751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).