3-hydroxy-N-(2-oxooxolan-3-yl)octanamide

C12H21NO4 — CID 11586792

IUPAC3-hydroxy-N-(2-oxooxolan-3-yl)octanamide
SMILESCCCCCC(O)CC(=O)NC1CCOC1=O
InChIInChI=1S/C12H21NO4/c1-2-3-4-5-9(14)8-11(15)13-10-6-7-17-12(10)16/h9-10,14H,2-8H2,1H3,(H,13,15)
InChIKeyXCZVBYOXRSFQBH-UHFFFAOYSA-N
MW243.30 g/mol
LogP0.75
Rot. Bonds7

About 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide

3-hydroxy-N-(2-oxooxolan-3-yl)octanamide (PubChem CID 11586792) has the molecular formula C12H21NO4 and a molecular weight of 243.30 g/mol. Its IUPAC name is 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide.

Molecular Properties

Compound Name3-hydroxy-N-(2-oxooxolan-3-yl)octanamide
PubChem CID11586792
Molecular FormulaC12H21NO4
Molecular Weight243.30 g/mol
Exact Mass243.15
IUPAC Name3-hydroxy-N-(2-oxooxolan-3-yl)octanamide
SMILESCCCCCC(O)CC(=O)NC1CCOC1=O
InChIInChI=1S/C12H21NO4/c1-2-3-4-5-9(14)8-11(15)13-10-6-7-17-12(10)16/h9-10,14H,2-8H2,1H3,(H,13,15)
InChIKeyXCZVBYOXRSFQBH-UHFFFAOYSA-N
XLogP0.75
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.30
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-Oxotetrahydrofuran-3-YL)octanamide
CID 6914579
N-((3S)-2-oxooxolan-3-yl)decanamide
CID 10131281
3-Hydroxy-N-((S)-2-oxotetrahydrofuran-3-yl)dodecanamide
CID 10891902
N-nonanoyl-L-Homoserine lactone
CID 56662027
Palmitoyl myristyl serinate
CID 54485594
N-Decanoyl-DL-homoserine lactone
CID 11644562
N-Octanoyl-DL-homoserine lactone
CID 3474204
(2S,5S,8R)-2-(hydroxymethyl)-5-methyl-3,6,15-trioxo-1,4,7-triazacyclopentadecane-8-carboxylic acid
CID 44286193
Tetradecanamide, 3-hydroxy-N-[(3S)-tetrahydro-2-oxo-3-furanyl]-
CID 10903547
12-hydroxy-3-oxo-N-[(3S)-2-oxooxolan-3-yl]dodecanamide
CID 11823149
(S)-2-((R)-3-Amino-2-hydroxy-heptanoylamino)-propionic acid ethyl ester
CID 15516888
N-(3-hydroxy-butanoyl)-homoserine lactone
CID 10330086

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide?
The IUPAC name of 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide (CID 11586792) is 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide.
What is the SMILES notation for 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide?
The canonical SMILES for 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide is CCCCCC(O)CC(=O)NC1CCOC1=O.
What is the InChIKey of 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide?
The InChIKey is XCZVBYOXRSFQBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO4/c1-2-3-4-5-9(14)8-11(15)13-10-6-7-17-12(10)16/h9-10,14H,2-8H2,1H3,(H,13,15).
What are the key properties of 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide?
3-hydroxy-N-(2-oxooxolan-3-yl)octanamide has a molecular weight of 243.30 g/mol, XLogP of 0.75, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(2-oxooxolan-3-yl)octanamide is sourced from PubChem (CID 11586792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).