N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide

C21H42N2O2 — CID 87619248

IUPACN-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
SMILESCCCCC(CC)COCCCN(C=O)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C21H42N2O2/c1-7-9-11-18(8-2)16-25-13-10-12-23(17-24)19-14-20(3,4)22-21(5,6)15-19/h17-19,22H,7-16H2,1-6H3
InChIKeyUZYLMXILFBMWCD-UHFFFAOYSA-N
MW354.58 g/mol
LogP4.38
Rot. Bonds12

About N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide

N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide (PubChem CID 87619248) has the molecular formula C21H42N2O2 and a molecular weight of 354.58 g/mol. Its IUPAC name is N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide.

Molecular Properties

Compound NameN-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
PubChem CID87619248
Molecular FormulaC21H42N2O2
Molecular Weight354.58 g/mol
Exact Mass354.32
IUPAC NameN-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide
SMILESCCCCC(CC)COCCCN(C=O)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C21H42N2O2/c1-7-9-11-18(8-2)16-25-13-10-12-23(17-24)19-14-20(3,4)22-21(5,6)15-19/h17-19,22H,7-16H2,1-6H3
InChIKeyUZYLMXILFBMWCD-UHFFFAOYSA-N
XLogP4.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.58
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide 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-[formyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]formamide
CID 87582665
2-[(2S)-2-ethylhexoxy]-N,N-bis[2-[(2S)-2-ethylhexoxy]ethyl]ethanamine
CID 97464992
(3R)-3-[[(2R)-2-ethylhexoxy]methyl]heptane
CID 91827254
2-[(2S)-2-ethylhexoxy]-N-[2-[(2R)-2-ethylhexoxy]ethyl]ethanamine
CID 27255212
1-[4-[2-[2-(2-ethylhexoxy)ethoxy]ethoxy]butoxy]dodecane
CID 129302674
bis[2-(2-ethylhexoxy)ethoxy]-oxoazanium
CID 57281107
tris[3-(2-ethylhexoxy)propyl]azanium
CID 173204281
3-(2-ethylhexoxymethyl)heptane;titanium
CID 87161815
3-(4-ethenoxybutoxymethyl)heptane
CID 139971607
decane;ethane;1-(2-ethyloctoxy)tetradecane
CID 155743358
(3S)-3-(2-chloroethoxymethyl)heptane
CID 40579971
8-(2-ethylhexoxy)octan-1-amine
CID 87537137

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The IUPAC name of N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide (CID 87619248) is N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide.
What is the SMILES notation for N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The canonical SMILES for N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide is CCCCC(CC)COCCCN(C=O)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
The InChIKey is UZYLMXILFBMWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H42N2O2/c1-7-9-11-18(8-2)16-25-13-10-12-23(17-24)19-14-20(3,4)22-21(5,6)15-19/h17-19,22H,7-16H2,1-6H3.
What are the key properties of N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide?
N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide has a molecular weight of 354.58 g/mol, XLogP of 4.38, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-ethylhexoxy)propyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide is sourced from PubChem (CID 87619248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).