N-benzyl-3-(2-methoxyanilino)propanamide

C17H20N2O2 — CID 109018840

IUPACN-benzyl-3-(2-methoxyanilino)propanamide
SMILESCOc1ccccc1NCCC(=O)NCc1ccccc1
InChIInChI=1S/C17H20N2O2/c1-21-16-10-6-5-9-15(16)18-12-11-17(20)19-13-14-7-3-2-4-8-14/h2-10,18H,11-13H2,1H3,(H,19,20)
InChIKeyZEEITVSQCWMSOS-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.81
Rot. Bonds7

About N-benzyl-3-(2-methoxyanilino)propanamide

N-benzyl-3-(2-methoxyanilino)propanamide (PubChem CID 109018840) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-benzyl-3-(2-methoxyanilino)propanamide.

Molecular Properties

Compound NameN-benzyl-3-(2-methoxyanilino)propanamide
PubChem CID109018840
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-benzyl-3-(2-methoxyanilino)propanamide
SMILESCOc1ccccc1NCCC(=O)NCc1ccccc1
InChIInChI=1S/C17H20N2O2/c1-21-16-10-6-5-9-15(16)18-12-11-17(20)19-13-14-7-3-2-4-8-14/h2-10,18H,11-13H2,1H3,(H,19,20)
InChIKeyZEEITVSQCWMSOS-UHFFFAOYSA-N
XLogP2.81
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-benzyl-3-(2-methoxyanilino)propanamide 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-benzyl-3-(2-ethylanilino)propanamide
CID 109018815
N-butyl-3-(2-methoxyanilino)propanamide
CID 109012291
3-(2,5-dimethoxyanilino)-N-[(4-methoxyphenyl)methyl]propanamide
CID 109022353
N-benzyl-3-[(2,3,4-trimethoxyphenyl)methylamino]propanamide
CID 51129427
3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide
CID 47877777
3-(2,5-dimethoxyanilino)-N-[(3,4-dimethoxyphenyl)methyl]propanamide
CID 109028189
3-(2-ethylanilino)-N-[(4-fluorophenyl)methyl]propanamide
CID 109021070
3-(3-chloro-2-methylanilino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 109022024
N-benzyl-3-(4-methylanilino)propanamide
CID 109018805
2-[3-[[3-(5-chloro-2-methoxyanilino)propanoylamino]methyl]phenoxy]acetic acid
CID 119246476
3-(2,5-dimethylanilino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 109022003
N-benzyl-2-[[2-(2-methoxyanilino)-2-oxoethyl]-propylamino]acetamide
CID 9168900

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-(2-methoxyanilino)propanamide?
The IUPAC name of N-benzyl-3-(2-methoxyanilino)propanamide (CID 109018840) is N-benzyl-3-(2-methoxyanilino)propanamide.
What is the SMILES notation for N-benzyl-3-(2-methoxyanilino)propanamide?
The canonical SMILES for N-benzyl-3-(2-methoxyanilino)propanamide is COc1ccccc1NCCC(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-3-(2-methoxyanilino)propanamide?
The InChIKey is ZEEITVSQCWMSOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-21-16-10-6-5-9-15(16)18-12-11-17(20)19-13-14-7-3-2-4-8-14/h2-10,18H,11-13H2,1H3,(H,19,20).
What are the key properties of N-benzyl-3-(2-methoxyanilino)propanamide?
N-benzyl-3-(2-methoxyanilino)propanamide has a molecular weight of 284.36 g/mol, XLogP of 2.81, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(2-methoxyanilino)propanamide is sourced from PubChem (CID 109018840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).