4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide

C10H18N2O3 — CID 142439333

IUPAC4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide
SMILESCC(C)CNC(=O)C1C(=O)NCCC1O
InChIInChI=1S/C10H18N2O3/c1-6(2)5-12-10(15)8-7(13)3-4-11-9(8)14/h6-8,13H,3-5H2,1-2H3,(H,11,14)(H,12,15)
InChIKeyWEHATORXOFRALP-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.74
Rot. Bonds3

About 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide

4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide (PubChem CID 142439333) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide
PubChem CID142439333
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide
SMILESCC(C)CNC(=O)C1C(=O)NCCC1O
InChIInChI=1S/C10H18N2O3/c1-6(2)5-12-10(15)8-7(13)3-4-11-9(8)14/h6-8,13H,3-5H2,1-2H3,(H,11,14)(H,12,15)
InChIKeyWEHATORXOFRALP-UHFFFAOYSA-N
XLogP-0.74
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide?
The IUPAC name of 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide (CID 142439333) is 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide.
What is the SMILES notation for 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide?
The canonical SMILES for 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide is CC(C)CNC(=O)C1C(=O)NCCC1O.
What is the InChIKey of 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide?
The InChIKey is WEHATORXOFRALP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-6(2)5-12-10(15)8-7(13)3-4-11-9(8)14/h6-8,13H,3-5H2,1-2H3,(H,11,14)(H,12,15).
What are the key properties of 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide?
4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide has a molecular weight of 214.26 g/mol, XLogP of -0.74, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-methylpropyl)-2-oxopiperidine-3-carboxamide is sourced from PubChem (CID 142439333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).