4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide

C23H38N2O3 — CID 143571154

IUPAC4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide
SMILESCCCN(CC)CC1CCCCC1NC(=O)c1ccc(OCCOCC)cc1
InChIInChI=1S/C23H38N2O3/c1-4-15-25(5-2)18-20-9-7-8-10-22(20)24-23(26)19-11-13-21(14-12-19)28-17-16-27-6-3/h11-14,20,22H,4-10,15-18H2,1-3H3,(H,24,26)
InChIKeyYNEOKINRGXYIHW-UHFFFAOYSA-N
MW390.57 g/mol
LogP4.12
Rot. Bonds12

About 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide

4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide (PubChem CID 143571154) has the molecular formula C23H38N2O3 and a molecular weight of 390.57 g/mol. Its IUPAC name is 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide.

Molecular Properties

Compound Name4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide
PubChem CID143571154
Molecular FormulaC23H38N2O3
Molecular Weight390.57 g/mol
Exact Mass390.29
IUPAC Name4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide
SMILESCCCN(CC)CC1CCCCC1NC(=O)c1ccc(OCCOCC)cc1
InChIInChI=1S/C23H38N2O3/c1-4-15-25(5-2)18-20-9-7-8-10-22(20)24-23(26)19-11-13-21(14-12-19)28-17-16-27-6-3/h11-14,20,22H,4-10,15-18H2,1-3H3,(H,24,26)
InChIKeyYNEOKINRGXYIHW-UHFFFAOYSA-N
XLogP4.12
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.57
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(1R,2R)-2-(diethylaminomethyl)cyclohexyl]-4-(2-ethoxyethoxy)benzamide
CID 24872684
N-[2-(aminomethyl)cyclohexyl]-4-butoxybenzamide
CID 119610066
4-ethoxy-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 103751428
N-[2-(chloromethyl)cyclopentyl]-4-ethoxybenzamide
CID 106365883
N-[2-[(dimethylamino)methyl]cyclohexyl]-4-methoxybenzamide
CID 110279273
N-(cyclohexylcarbamothioyl)-4-(2-ethoxyethoxy)benzamide
CID 17112920
4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide
CID 24873264
N-cyclohexyl-4-propoxybenzamide
CID 4938429
N-[2-(bromomethyl)cyclohexyl]-4-(dimethylamino)benzamide
CID 106367084
4-[2-[ethyl(propyl)amino]ethoxy]benzohydrazide
CID 55213633
N'-[4-(2-ethoxyethoxy)benzoyl]-4-hexoxybenzohydrazide
CID 17112816
4-butoxy-N-cyclobutylbenzamide
CID 71449411

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide?
The IUPAC name of 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide (CID 143571154) is 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide.
What is the SMILES notation for 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide?
The canonical SMILES for 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide is CCCN(CC)CC1CCCCC1NC(=O)c1ccc(OCCOCC)cc1.
What is the InChIKey of 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide?
The InChIKey is YNEOKINRGXYIHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H38N2O3/c1-4-15-25(5-2)18-20-9-7-8-10-22(20)24-23(26)19-11-13-21(14-12-19)28-17-16-27-6-3/h11-14,20,22H,4-10,15-18H2,1-3H3,(H,24,26).
What are the key properties of 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide?
4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide has a molecular weight of 390.57 g/mol, XLogP of 4.12, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyethoxy)-N-[2-[[ethyl(propyl)amino]methyl]cyclohexyl]benzamide is sourced from PubChem (CID 143571154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).