N-(2-hydroxypropyl)octanamide

C11H23NO2 — CID 5463938

IUPACN-(2-hydroxypropyl)octanamide
SMILESCCCCCCCC(=O)NCC(C)O
InChIInChI=1S/C11H23NO2/c1-3-4-5-6-7-8-11(14)12-9-10(2)13/h10,13H,3-9H2,1-2H3,(H,12,14)
InChIKeyHYALHALGUKZZPY-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.84
Rot. Bonds8

About N-(2-hydroxypropyl)octanamide

N-(2-hydroxypropyl)octanamide (PubChem CID 5463938) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(2-hydroxypropyl)octanamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)octanamide
PubChem CID5463938
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-(2-hydroxypropyl)octanamide
SMILESCCCCCCCC(=O)NCC(C)O
InChIInChI=1S/C11H23NO2/c1-3-4-5-6-7-8-11(14)12-9-10(2)13/h10,13H,3-9H2,1-2H3,(H,12,14)
InChIKeyHYALHALGUKZZPY-UHFFFAOYSA-N
XLogP1.84
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.84
H-Bond Donors ≤ 52
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-(2-hydroxypropyl)octanamide?
The IUPAC name of N-(2-hydroxypropyl)octanamide (CID 5463938) is N-(2-hydroxypropyl)octanamide.
What is the SMILES notation for N-(2-hydroxypropyl)octanamide?
The canonical SMILES for N-(2-hydroxypropyl)octanamide is CCCCCCCC(=O)NCC(C)O.
What is the InChIKey of N-(2-hydroxypropyl)octanamide?
The InChIKey is HYALHALGUKZZPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-3-4-5-6-7-8-11(14)12-9-10(2)13/h10,13H,3-9H2,1-2H3,(H,12,14).
What are the key properties of N-(2-hydroxypropyl)octanamide?
N-(2-hydroxypropyl)octanamide has a molecular weight of 201.31 g/mol, XLogP of 1.84, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)octanamide is sourced from PubChem (CID 5463938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).