N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide

C17H34N2O2 — CID 170293250

IUPACN-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide
SMILESCCCCCCCC(=O)N(OCCNC)C1CCCCC1
InChIInChI=1S/C17H34N2O2/c1-3-4-5-6-10-13-17(20)19(21-15-14-18-2)16-11-8-7-9-12-16/h16,18H,3-15H2,1-2H3
InChIKeyLSPWUQZTAGZTDY-UHFFFAOYSA-N
MW298.47 g/mol
LogP3.66
Rot. Bonds11

About N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide

N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide (PubChem CID 170293250) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide.

Molecular Properties

Compound NameN-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide
PubChem CID170293250
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC NameN-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide
SMILESCCCCCCCC(=O)N(OCCNC)C1CCCCC1
InChIInChI=1S/C17H34N2O2/c1-3-4-5-6-10-13-17(20)19(21-15-14-18-2)16-11-8-7-9-12-16/h16,18H,3-15H2,1-2H3
InChIKeyLSPWUQZTAGZTDY-UHFFFAOYSA-N
XLogP3.66
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane
CID 158754691
ethyl N-cyclohexyl-N-octadecoxycarbamate
CID 149251240
(2E,4Z)-N-[2-[cyclohexyl-[6-(methylamino)hexanoyl]amino]oxyethyl]-2-ethenyl-N-methylhexa-2,4-dienamide;ethane
CID 142465018
N-(2-chloroethyl)-N-cyclohexyloctanamide
CID 63391554
N-(2-bromoethyl)-N-cyclohexyloctanamide
CID 80658420
N-cyclobutyl-N-(3-hydroxypropyl)decanamide
CID 102866665
tert-butyl N-[2-[7-aminoheptanoyl(cyclohexyl)amino]oxyethyl]-N-methylcarbamate
CID 134458734
N,N'-dicyclohexyl-N,N'-diethyltetradecanediamide
CID 20752264
N-(3-aminopropyl)-N-cycloheptylheptanamide
CID 114751887
N-[dicyclohexyl(methylamino)methyl]-N-methyldodecanamide
CID 141461896
N-cyclopentyl-N-(2-hydroxyethyl)-4-(methylamino)butanamide
CID 60953691
hexyl 4-(dicyclohexylamino)-4-oxobutanoate
CID 91701072

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide?
The IUPAC name of N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide (CID 170293250) is N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide.
What is the SMILES notation for N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide?
The canonical SMILES for N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide is CCCCCCCC(=O)N(OCCNC)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide?
The InChIKey is LSPWUQZTAGZTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-3-4-5-6-10-13-17(20)19(21-15-14-18-2)16-11-8-7-9-12-16/h16,18H,3-15H2,1-2H3.
What are the key properties of N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide?
N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide has a molecular weight of 298.47 g/mol, XLogP of 3.66, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide is sourced from PubChem (CID 170293250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).