N-(2-oxooxolan-3-yl)dodecanamide

C16H29NO3 — CID 11565426

IUPACN-(2-oxooxolan-3-yl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NC1CCOC1=O
InChIInChI=1S/C16H29NO3/c1-2-3-4-5-6-7-8-9-10-11-15(18)17-14-12-13-20-16(14)19/h14H,2-13H2,1H3,(H,17,18)
InChIKeyWILLZMOKUUPJSL-UHFFFAOYSA-N
MW283.41 g/mol
LogP3.34
Rot. Bonds11

About N-(2-oxooxolan-3-yl)dodecanamide

N-(2-oxooxolan-3-yl)dodecanamide (PubChem CID 11565426) has the molecular formula C16H29NO3 and a molecular weight of 283.41 g/mol. Its IUPAC name is N-(2-oxooxolan-3-yl)dodecanamide.

Molecular Properties

Compound NameN-(2-oxooxolan-3-yl)dodecanamide
PubChem CID11565426
Molecular FormulaC16H29NO3
Molecular Weight283.41 g/mol
Exact Mass283.21
IUPAC NameN-(2-oxooxolan-3-yl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NC1CCOC1=O
InChIInChI=1S/C16H29NO3/c1-2-3-4-5-6-7-8-9-10-11-15(18)17-14-12-13-20-16(14)19/h14H,2-13H2,1H3,(H,17,18)
InChIKeyWILLZMOKUUPJSL-UHFFFAOYSA-N
XLogP3.34
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-oxooxolan-3-yl)dodecanamide 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-3-Oxo-Dodecanoyl-L-Homoserine Lactone
CID 3246941
N-dodecanoyl-L-Homoserine lactone
CID 10221437
N-(beta-Oxooctan-1-oyl)homoserine lactone
CID 127293
N-(3-Oxotetradecanoyl)-L-homoserine lactone
CID 9883786
N-(2-Oxotetrahydrofuran-3-YL)octanamide
CID 6914579
N-((3S)-2-oxooxolan-3-yl)decanamide
CID 10131281
N-(3-oxodecanoyl)-L-homoserine lactone
CID 10221060
N-(3-oxohexanoyl)-L-homoserine lactone
CID 688505
N-Heptanoylhomoserine lactone
CID 443437
N-Hexanoyl-L-Homoserine lactone
CID 10058590
3-oxo-N-(tetrahydro-2-oxo-3-furanyl)hexanamide
CID 119133
3-oxo-N-(tetrahydro-2-oxo-3-furanyl)dodecanamide
CID 127864

Frequently Asked Questions

What is the IUPAC name of N-(2-oxooxolan-3-yl)dodecanamide?
The IUPAC name of N-(2-oxooxolan-3-yl)dodecanamide (CID 11565426) is N-(2-oxooxolan-3-yl)dodecanamide.
What is the SMILES notation for N-(2-oxooxolan-3-yl)dodecanamide?
The canonical SMILES for N-(2-oxooxolan-3-yl)dodecanamide is CCCCCCCCCCCC(=O)NC1CCOC1=O.
What is the InChIKey of N-(2-oxooxolan-3-yl)dodecanamide?
The InChIKey is WILLZMOKUUPJSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO3/c1-2-3-4-5-6-7-8-9-10-11-15(18)17-14-12-13-20-16(14)19/h14H,2-13H2,1H3,(H,17,18).
What are the key properties of N-(2-oxooxolan-3-yl)dodecanamide?
N-(2-oxooxolan-3-yl)dodecanamide has a molecular weight of 283.41 g/mol, XLogP of 3.34, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxooxolan-3-yl)dodecanamide is sourced from PubChem (CID 11565426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).