2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide

C17H25N3O2 — CID 8533440

IUPAC2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide
SMILESCCN(CC(=O)NC(=O)NC1CCCC1)Cc1ccccc1
InChIInChI=1S/C17H25N3O2/c1-2-20(12-14-8-4-3-5-9-14)13-16(21)19-17(22)18-15-10-6-7-11-15/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H2,18,19,21,22)
InChIKeyWLMISUPFOYUTMZ-UHFFFAOYSA-N
MW303.41 g/mol
LogP2.28
Rot. Bonds6

About 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide

2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide (PubChem CID 8533440) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide
PubChem CID8533440
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide
SMILESCCN(CC(=O)NC(=O)NC1CCCC1)Cc1ccccc1
InChIInChI=1S/C17H25N3O2/c1-2-20(12-14-8-4-3-5-9-14)13-16(21)19-17(22)18-15-10-6-7-11-15/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H2,18,19,21,22)
InChIKeyWLMISUPFOYUTMZ-UHFFFAOYSA-N
XLogP2.28
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide?
The IUPAC name of 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide (CID 8533440) is 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide.
What is the SMILES notation for 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide?
The canonical SMILES for 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide is CCN(CC(=O)NC(=O)NC1CCCC1)Cc1ccccc1.
What is the InChIKey of 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide?
The InChIKey is WLMISUPFOYUTMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-2-20(12-14-8-4-3-5-9-14)13-16(21)19-17(22)18-15-10-6-7-11-15/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H2,18,19,21,22).
What are the key properties of 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide?
2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide has a molecular weight of 303.41 g/mol, XLogP of 2.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(ethyl)amino]-N-(cyclopentylcarbamoyl)acetamide is sourced from PubChem (CID 8533440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).