N-cyclooctyl-2-ethylhexanamide

C16H31NO — CID 3989939

IUPACN-cyclooctyl-2-ethylhexanamide
SMILESCCCCC(CC)C(=O)NC1CCCCCCC1
InChIInChI=1S/C16H31NO/c1-3-5-11-14(4-2)16(18)17-15-12-9-7-6-8-10-13-15/h14-15H,3-13H2,1-2H3,(H,17,18)
InChIKeyZEOXCZJMZJUMJC-UHFFFAOYSA-N
MW253.43 g/mol
LogP4.43
Rot. Bonds6

About N-cyclooctyl-2-ethylhexanamide

N-cyclooctyl-2-ethylhexanamide (PubChem CID 3989939) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is N-cyclooctyl-2-ethylhexanamide.

Molecular Properties

Compound NameN-cyclooctyl-2-ethylhexanamide
PubChem CID3989939
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC NameN-cyclooctyl-2-ethylhexanamide
SMILESCCCCC(CC)C(=O)NC1CCCCCCC1
InChIInChI=1S/C16H31NO/c1-3-5-11-14(4-2)16(18)17-15-12-9-7-6-8-10-13-15/h14-15H,3-13H2,1-2H3,(H,17,18)
InChIKeyZEOXCZJMZJUMJC-UHFFFAOYSA-N
XLogP4.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-cyclooctyl-2-ethylhexanamide 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-cyclopentyl-2-ethylhexanamide
CID 4146053
5-amino-N-cycloheptyl-2-ethylpentanamide
CID 112515741
5-amino-N-cyclopentyl-2-ethylpentanamide
CID 112515263
2-(cyclohexylcarbamoyl)hexane-1-diazonium
CID 174456340
N-cyclooctyl-2-ethyl-8-hydroxy-6-methyl-7-oxooctanamide
CID 165053172
2-(2-ethylhexanoylamino)cyclohexane-1-carboxylic acid
CID 64814795
(2S)-2-amino-N-cycloheptylhexanamide
CID 103830902
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-ethylhexanamide
CID 61233106
N-(2-amino-1-cyclohexylethyl)-2-ethylhexanamide
CID 81486044
5-amino-N-cyclopropyl-2-ethylpentanamide
CID 112515117
N-cyclopropyl-2-ethylbutanamide
CID 5151098
(2R)-2-ethyl-N-[(3S)-2-oxoazepan-3-yl]hexanamide
CID 11379810

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-2-ethylhexanamide?
The IUPAC name of N-cyclooctyl-2-ethylhexanamide (CID 3989939) is N-cyclooctyl-2-ethylhexanamide.
What is the SMILES notation for N-cyclooctyl-2-ethylhexanamide?
The canonical SMILES for N-cyclooctyl-2-ethylhexanamide is CCCCC(CC)C(=O)NC1CCCCCCC1.
What is the InChIKey of N-cyclooctyl-2-ethylhexanamide?
The InChIKey is ZEOXCZJMZJUMJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-3-5-11-14(4-2)16(18)17-15-12-9-7-6-8-10-13-15/h14-15H,3-13H2,1-2H3,(H,17,18).
What are the key properties of N-cyclooctyl-2-ethylhexanamide?
N-cyclooctyl-2-ethylhexanamide has a molecular weight of 253.43 g/mol, XLogP of 4.43, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-2-ethylhexanamide is sourced from PubChem (CID 3989939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).