1-octanoylpiperidine-2-carboxamide

C14H26N2O2 — CID 162646892

IUPAC1-octanoylpiperidine-2-carboxamide
SMILESCCCCCCCC(=O)N1CCCCC1C(N)=O
InChIInChI=1S/C14H26N2O2/c1-2-3-4-5-6-10-13(17)16-11-8-7-9-12(16)14(15)18/h12H,2-11H2,1H3,(H2,15,18)
InChIKeyPWUYOHXARPPGDA-UHFFFAOYSA-N
MW254.37 g/mol
LogP2.21
Rot. Bonds7

About 1-octanoylpiperidine-2-carboxamide

1-octanoylpiperidine-2-carboxamide (PubChem CID 162646892) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-octanoylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-octanoylpiperidine-2-carboxamide
PubChem CID162646892
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name1-octanoylpiperidine-2-carboxamide
SMILESCCCCCCCC(=O)N1CCCCC1C(N)=O
InChIInChI=1S/C14H26N2O2/c1-2-3-4-5-6-10-13(17)16-11-8-7-9-12(16)14(15)18/h12H,2-11H2,1H3,(H2,15,18)
InChIKeyPWUYOHXARPPGDA-UHFFFAOYSA-N
XLogP2.21
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-octanoylpiperidine-2-carboxamide?
The IUPAC name of 1-octanoylpiperidine-2-carboxamide (CID 162646892) is 1-octanoylpiperidine-2-carboxamide.
What is the SMILES notation for 1-octanoylpiperidine-2-carboxamide?
The canonical SMILES for 1-octanoylpiperidine-2-carboxamide is CCCCCCCC(=O)N1CCCCC1C(N)=O.
What is the InChIKey of 1-octanoylpiperidine-2-carboxamide?
The InChIKey is PWUYOHXARPPGDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-2-3-4-5-6-10-13(17)16-11-8-7-9-12(16)14(15)18/h12H,2-11H2,1H3,(H2,15,18).
What are the key properties of 1-octanoylpiperidine-2-carboxamide?
1-octanoylpiperidine-2-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-octanoylpiperidine-2-carboxamide is sourced from PubChem (CID 162646892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).