N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide

C19H29N3O3 — CID 95342156

IUPACN'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide
SMILESCCOc1ccccc1NC(=O)C(=O)NC[C@@H](C)CN1CCCCC1
InChIInChI=1S/C19H29N3O3/c1-3-25-17-10-6-5-9-16(17)21-19(24)18(23)20-13-15(2)14-22-11-7-4-8-12-22/h5-6,9-10,15H,3-4,7-8,11-14H2,1-2H3,(H,20,23)(H,21,24)/t15-/m1/s1
InChIKeyINXKNWLRYBMSKT-OAHLLOKOSA-N
MW347.46 g/mol
LogP2.26
Rot. Bonds7

About N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide

N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide (PubChem CID 95342156) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide.

Molecular Properties

Compound NameN'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide
PubChem CID95342156
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC NameN'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide
SMILESCCOc1ccccc1NC(=O)C(=O)NC[C@@H](C)CN1CCCCC1
InChIInChI=1S/C19H29N3O3/c1-3-25-17-10-6-5-9-16(17)21-19(24)18(23)20-13-15(2)14-22-11-7-4-8-12-22/h5-6,9-10,15H,3-4,7-8,11-14H2,1-2H3,(H,20,23)(H,21,24)/t15-/m1/s1
InChIKeyINXKNWLRYBMSKT-OAHLLOKOSA-N
XLogP2.26
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide 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'-(2-methoxyphenyl)-N-[(2S)-2-methyl-3-(4-methylpiperazin-1-yl)propyl]oxamide
CID 95341968
N'-(2,4-difluorophenyl)-N-[(2S)-2-methyl-3-piperidin-1-ylpropyl]oxamide
CID 95351012
N'-(4-methylphenyl)-N-(2-methyl-3-piperidin-1-ylpropyl)oxamide
CID 60530240
1-[(2-ethoxyphenyl)methyl]-2-methyl-3-(2-methyl-3-piperidin-1-ylpropyl)guanidine;hydroiodide
CID 111881018
2-ethoxy-N-[(2S)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]benzamide
CID 95336956
N-cyclohexyl-N'-(2-ethoxyphenyl)oxamide
CID 7585382
[(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] 4-(piperidin-1-ylmethyl)benzoate
CID 27110204
N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
CID 108523411
N-[2-[4-(dimethylamino)phenyl]-2-(4-methylpiperazin-1-yl)ethyl]-N'-(2-ethoxyphenyl)oxamide
CID 43996750
N-[(2S)-2-(dimethylamino)-2-[4-(dimethylamino)phenyl]ethyl]-N'-(2-ethoxyphenyl)oxamide
CID 7192247
N-[(2S)-2-[4-(dimethylamino)phenyl]-2-pyrrolidin-1-ium-1-ylethyl]-N'-(2-ethoxyphenyl)oxamide
CID 7644813
N-(2-ethoxyphenyl)-N'-(4-methylpiperazin-1-yl)oxamide
CID 45000656

Frequently Asked Questions

What is the IUPAC name of N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide?
The IUPAC name of N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide (CID 95342156) is N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide.
What is the SMILES notation for N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide?
The canonical SMILES for N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide is CCOc1ccccc1NC(=O)C(=O)NC[C@@H](C)CN1CCCCC1.
What is the InChIKey of N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide?
The InChIKey is INXKNWLRYBMSKT-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H29N3O3/c1-3-25-17-10-6-5-9-16(17)21-19(24)18(23)20-13-15(2)14-22-11-7-4-8-12-22/h5-6,9-10,15H,3-4,7-8,11-14H2,1-2H3,(H,20,23)(H,21,24)/t15-/m1/s1.
What are the key properties of N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide?
N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide has a molecular weight of 347.46 g/mol, XLogP of 2.26, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-ethoxyphenyl)-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]oxamide is sourced from PubChem (CID 95342156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).