3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide

C16H26N2O2 — CID 109015351

IUPAC3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide
SMILESCCN(CCC(=O)NCCCOC)Cc1ccccc1
InChIInChI=1S/C16H26N2O2/c1-3-18(14-15-8-5-4-6-9-15)12-10-16(19)17-11-7-13-20-2/h4-6,8-9H,3,7,10-14H2,1-2H3,(H,17,19)
InChIKeyPRSKIUBMVUJFIT-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.05
Rot. Bonds10

About 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide

3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide (PubChem CID 109015351) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide.

Molecular Properties

Compound Name3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide
PubChem CID109015351
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide
SMILESCCN(CCC(=O)NCCCOC)Cc1ccccc1
InChIInChI=1S/C16H26N2O2/c1-3-18(14-15-8-5-4-6-9-15)12-10-16(19)17-11-7-13-20-2/h4-6,8-9H,3,7,10-14H2,1-2H3,(H,17,19)
InChIKeyPRSKIUBMVUJFIT-UHFFFAOYSA-N
XLogP2.05
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)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

2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide
CID 78787360
3-[benzyl(ethyl)amino]-N-(3-methylbutyl)propanamide
CID 109023063
N-[3-[benzyl(ethyl)amino]propyl]-3-pyrrol-1-ylpropanamide
CID 46343167
N-[2-(3-methoxypropylamino)-2-oxoethyl]-3-phenylpropanamide
CID 112991215
N-benzyl-N-[3-(3-methoxypropylamino)-3-oxopropyl]-5-methylpyrazine-2-carboxamide
CID 5178704
1-benzyl-3-(3-methoxypropyl)-1-methylurea
CID 108988118
methyl 3-[[2-[benzyl(ethyl)amino]acetyl]amino]propanoate
CID 78815356
3-[benzyl(methyl)amino]-N-(3-phenylpropyl)propanamide
CID 109020589
2-[benzyl(4-methoxybutyl)amino]acetic acid
CID 119134936
methyl 2-[3-[benzyl(ethyl)amino]propanoylamino]benzoate
CID 109023113
3-[benzyl(ethyl)amino]-N-(3,5-dimethoxyphenyl)propanamide
CID 1340180
N-(3-methoxypropyl)-3-phenylsulfanylpropanamide
CID 3138314

Frequently Asked Questions

What is the IUPAC name of 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide?
The IUPAC name of 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide (CID 109015351) is 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide.
What is the SMILES notation for 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide?
The canonical SMILES for 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide is CCN(CCC(=O)NCCCOC)Cc1ccccc1.
What is the InChIKey of 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide?
The InChIKey is PRSKIUBMVUJFIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-3-18(14-15-8-5-4-6-9-15)12-10-16(19)17-11-7-13-20-2/h4-6,8-9H,3,7,10-14H2,1-2H3,(H,17,19).
What are the key properties of 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide?
3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide has a molecular weight of 278.40 g/mol, XLogP of 2.05, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[benzyl(ethyl)amino]-N-(3-methoxypropyl)propanamide is sourced from PubChem (CID 109015351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).