N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide

C17H25N3O3 — CID 54836035

IUPACN-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide
SMILESCOCCNC(=O)c1cccc(NCC(=O)N2CCCCC2)c1
InChIInChI=1S/C17H25N3O3/c1-23-11-8-18-17(22)14-6-5-7-15(12-14)19-13-16(21)20-9-3-2-4-10-20/h5-7,12,19H,2-4,8-11,13H2,1H3,(H,18,22)
InChIKeyIEJNTYJDYUSQMW-UHFFFAOYSA-N
MW319.41 g/mol
LogP1.49
Rot. Bonds7

About N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide

N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide (PubChem CID 54836035) has the molecular formula C17H25N3O3 and a molecular weight of 319.41 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide
PubChem CID54836035
Molecular FormulaC17H25N3O3
Molecular Weight319.41 g/mol
Exact Mass319.19
IUPAC NameN-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide
SMILESCOCCNC(=O)c1cccc(NCC(=O)N2CCCCC2)c1
InChIInChI=1S/C17H25N3O3/c1-23-11-8-18-17(22)14-6-5-7-15(12-14)19-13-16(21)20-9-3-2-4-10-20/h5-7,12,19H,2-4,8-11,13H2,1H3,(H,18,22)
InChIKeyIEJNTYJDYUSQMW-UHFFFAOYSA-N
XLogP1.49
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[[2-(azepan-1-yl)-2-oxoethyl]amino]-N-(3-methoxypropyl)benzamide
CID 54842504
4-[[2-(azepan-1-yl)-2-oxoethyl]amino]-N-(2-methoxyethyl)benzamide
CID 54836236
N-(2-methoxyethyl)-3-[[2-[3-(pyrrolidine-1-carbonyl)anilino]acetyl]amino]benzamide
CID 54841294
N-(2-methoxyethyl)-3-[[2-[4-(pyrrolidine-1-carbonyl)anilino]acetyl]amino]benzamide
CID 54834227
3-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]amino]-N-(2-methoxyethyl)benzamide
CID 54836165
1-(4-methylpiperidin-1-yl)-2-[3-(piperidine-1-carbonyl)anilino]ethanone
CID 54843401
3-(cyclohexanecarbonylamino)-N-(2-methoxyethyl)benzamide
CID 17218956
N-(3-methoxypropyl)-3-(piperidine-1-carbonyl)benzamide
CID 109051970
methyl 3-[(3-oxo-3-piperidin-1-ylpropyl)amino]benzoate
CID 109013882
1-(azepan-1-yl)-2-(3-propoxyanilino)ethanone
CID 54824937
N-tert-butyl-3-[[2-[3-(2-methoxyethylcarbamoyl)anilino]-2-oxoethyl]amino]benzamide
CID 54844392
3-[[2-(4-chloroanilino)-2-oxoethyl]amino]-N-(2-methoxyethyl)benzamide
CID 54836164

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide?
The IUPAC name of N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide (CID 54836035) is N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide?
The canonical SMILES for N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide is COCCNC(=O)c1cccc(NCC(=O)N2CCCCC2)c1.
What is the InChIKey of N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide?
The InChIKey is IEJNTYJDYUSQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-23-11-8-18-17(22)14-6-5-7-15(12-14)19-13-16(21)20-9-3-2-4-10-20/h5-7,12,19H,2-4,8-11,13H2,1H3,(H,18,22).
What are the key properties of N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide?
N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide has a molecular weight of 319.41 g/mol, XLogP of 1.49, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-[(2-oxo-2-piperidin-1-ylethyl)amino]benzamide is sourced from PubChem (CID 54836035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).