N-octyl-2-piperidin-1-ylacetamide

C15H30N2O — CID 3063688

IUPACN-octyl-2-piperidin-1-ylacetamide
SMILESCCCCCCCCNC(=O)CN1CCCCC1
InChIInChI=1S/C15H30N2O/c1-2-3-4-5-6-8-11-16-15(18)14-17-12-9-7-10-13-17/h2-14H2,1H3,(H,16,18)
InChIKeyJILFJCBEJOZONX-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.95
Rot. Bonds9

About N-octyl-2-piperidin-1-ylacetamide

N-octyl-2-piperidin-1-ylacetamide (PubChem CID 3063688) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-octyl-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-octyl-2-piperidin-1-ylacetamide
PubChem CID3063688
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-octyl-2-piperidin-1-ylacetamide
SMILESCCCCCCCCNC(=O)CN1CCCCC1
InChIInChI=1S/C15H30N2O/c1-2-3-4-5-6-8-11-16-15(18)14-17-12-9-7-10-13-17/h2-14H2,1H3,(H,16,18)
InChIKeyJILFJCBEJOZONX-UHFFFAOYSA-N
XLogP2.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.95
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 N-octyl-2-piperidin-1-ylacetamide?
The IUPAC name of N-octyl-2-piperidin-1-ylacetamide (CID 3063688) is N-octyl-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-octyl-2-piperidin-1-ylacetamide?
The canonical SMILES for N-octyl-2-piperidin-1-ylacetamide is CCCCCCCCNC(=O)CN1CCCCC1.
What is the InChIKey of N-octyl-2-piperidin-1-ylacetamide?
The InChIKey is JILFJCBEJOZONX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-2-3-4-5-6-8-11-16-15(18)14-17-12-9-7-10-13-17/h2-14H2,1H3,(H,16,18).
What are the key properties of N-octyl-2-piperidin-1-ylacetamide?
N-octyl-2-piperidin-1-ylacetamide has a molecular weight of 254.42 g/mol, XLogP of 2.95, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-octyl-2-piperidin-1-ylacetamide is sourced from PubChem (CID 3063688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).