N-cyclohexyl-2-oxopiperidine-3-carboxamide

C12H20N2O2 — CID 2911346

IUPACN-cyclohexyl-2-oxopiperidine-3-carboxamide
SMILESO=C1NCCCC1C(=O)NC1CCCCC1
InChIInChI=1S/C12H20N2O2/c15-11-10(7-4-8-13-11)12(16)14-9-5-2-1-3-6-9/h9-10H,1-8H2,(H,13,15)(H,14,16)
InChIKeyKKDWUKFAPPIWJH-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.96
Rot. Bonds2

About N-cyclohexyl-2-oxopiperidine-3-carboxamide

N-cyclohexyl-2-oxopiperidine-3-carboxamide (PubChem CID 2911346) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N-cyclohexyl-2-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-oxopiperidine-3-carboxamide
PubChem CID2911346
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN-cyclohexyl-2-oxopiperidine-3-carboxamide
SMILESO=C1NCCCC1C(=O)NC1CCCCC1
InChIInChI=1S/C12H20N2O2/c15-11-10(7-4-8-13-11)12(16)14-9-5-2-1-3-6-9/h9-10H,1-8H2,(H,13,15)(H,14,16)
InChIKeyKKDWUKFAPPIWJH-UHFFFAOYSA-N
XLogP0.96
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 N-cyclohexyl-2-oxopiperidine-3-carboxamide?
The IUPAC name of N-cyclohexyl-2-oxopiperidine-3-carboxamide (CID 2911346) is N-cyclohexyl-2-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-oxopiperidine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-2-oxopiperidine-3-carboxamide is O=C1NCCCC1C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-oxopiperidine-3-carboxamide?
The InChIKey is KKDWUKFAPPIWJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c15-11-10(7-4-8-13-11)12(16)14-9-5-2-1-3-6-9/h9-10H,1-8H2,(H,13,15)(H,14,16).
What are the key properties of N-cyclohexyl-2-oxopiperidine-3-carboxamide?
N-cyclohexyl-2-oxopiperidine-3-carboxamide has a molecular weight of 224.30 g/mol, XLogP of 0.96, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-oxopiperidine-3-carboxamide is sourced from PubChem (CID 2911346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).