N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide

C21H27N3O2 — CID 53366849

IUPACN-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide
SMILESO=C(CN1C(=O)C(c2ccccc2)=NC12CCCCC2)NC1CCCC1
InChIInChI=1S/C21H27N3O2/c25-18(22-17-11-5-6-12-17)15-24-20(26)19(16-9-3-1-4-10-16)23-21(24)13-7-2-8-14-21/h1,3-4,9-10,17H,2,5-8,11-15H2,(H,22,25)
InChIKeyPWLQLDWUXCZUTC-UHFFFAOYSA-N
MW353.47 g/mol
LogP3.04
Rot. Bonds4

About N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide

N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide (PubChem CID 53366849) has the molecular formula C21H27N3O2 and a molecular weight of 353.47 g/mol. Its IUPAC name is N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide
PubChem CID53366849
Molecular FormulaC21H27N3O2
Molecular Weight353.47 g/mol
Exact Mass353.21
IUPAC NameN-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide
SMILESO=C(CN1C(=O)C(c2ccccc2)=NC12CCCCC2)NC1CCCC1
InChIInChI=1S/C21H27N3O2/c25-18(22-17-11-5-6-12-17)15-24-20(26)19(16-9-3-1-4-10-16)23-21(24)13-7-2-8-14-21/h1,3-4,9-10,17H,2,5-8,11-15H2,(H,22,25)
InChIKeyPWLQLDWUXCZUTC-UHFFFAOYSA-N
XLogP3.04
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)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 N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide?
The IUPAC name of N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide (CID 53366849) is N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide is O=C(CN1C(=O)C(c2ccccc2)=NC12CCCCC2)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide?
The InChIKey is PWLQLDWUXCZUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2/c25-18(22-17-11-5-6-12-17)15-24-20(26)19(16-9-3-1-4-10-16)23-21(24)13-7-2-8-14-21/h1,3-4,9-10,17H,2,5-8,11-15H2,(H,22,25).
What are the key properties of N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide?
N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide has a molecular weight of 353.47 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(3-oxo-2-phenyl-1,4-diazaspiro[4.5]dec-1-en-4-yl)acetamide is sourced from PubChem (CID 53366849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).