(2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide

C20H25N5O3 — CID 97281204

IUPAC(2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide
SMILESO=C1OCCN1c1ccccc1NC(=O)N1CCCC[C@@H]1CCn1cccn1
InChIInChI=1S/C20H25N5O3/c26-19(22-17-7-1-2-8-18(17)25-14-15-28-20(25)27)24-12-4-3-6-16(24)9-13-23-11-5-10-21-23/h1-2,5,7-8,10-11,16H,3-4,6,9,12-15H2,(H,22,26)/t16-/m1/s1
InChIKeyVKYGUPPPORVIHR-MRXNPFEDSA-N
MW383.45 g/mol
LogP3.32
Rot. Bonds5

About (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide

(2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide (PubChem CID 97281204) has the molecular formula C20H25N5O3 and a molecular weight of 383.45 g/mol. Its IUPAC name is (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide
PubChem CID97281204
Molecular FormulaC20H25N5O3
Molecular Weight383.45 g/mol
Exact Mass383.20
IUPAC Name(2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide
SMILESO=C1OCCN1c1ccccc1NC(=O)N1CCCC[C@@H]1CCn1cccn1
InChIInChI=1S/C20H25N5O3/c26-19(22-17-7-1-2-8-18(17)25-14-15-28-20(25)27)24-12-4-3-6-16(24)9-13-23-11-5-10-21-23/h1-2,5,7-8,10-11,16H,3-4,6,9,12-15H2,(H,22,26)/t16-/m1/s1
InChIKeyVKYGUPPPORVIHR-MRXNPFEDSA-N
XLogP3.32
TPSA79.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide?
The IUPAC name of (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide (CID 97281204) is (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide.
What is the SMILES notation for (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide?
The canonical SMILES for (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide is O=C1OCCN1c1ccccc1NC(=O)N1CCCC[C@@H]1CCn1cccn1.
What is the InChIKey of (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide?
The InChIKey is VKYGUPPPORVIHR-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H25N5O3/c26-19(22-17-7-1-2-8-18(17)25-14-15-28-20(25)27)24-12-4-3-6-16(24)9-13-23-11-5-10-21-23/h1-2,5,7-8,10-11,16H,3-4,6,9,12-15H2,(H,22,26)/t16-/m1/s1.
What are the key properties of (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide?
(2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide is sourced from PubChem (CID 97281204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).