N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide

C16H26N4O4 — CID 110246700

IUPACN-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide
SMILESO=C1CN(CC(=O)N2CCOC(C(=O)NC3CCCC3)C2)CCN1
InChIInChI=1S/C16H26N4O4/c21-14-10-19(6-5-17-14)11-15(22)20-7-8-24-13(9-20)16(23)18-12-3-1-2-4-12/h12-13H,1-11H2,(H,17,21)(H,18,23)
InChIKeyUYUURLSOJFFGCL-UHFFFAOYSA-N
MW338.41 g/mol
LogP-1.30
Rot. Bonds4

About N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide

N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide (PubChem CID 110246700) has the molecular formula C16H26N4O4 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide
PubChem CID110246700
Molecular FormulaC16H26N4O4
Molecular Weight338.41 g/mol
Exact Mass338.20
IUPAC NameN-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide
SMILESO=C1CN(CC(=O)N2CCOC(C(=O)NC3CCCC3)C2)CCN1
InChIInChI=1S/C16H26N4O4/c21-14-10-19(6-5-17-14)11-15(22)20-7-8-24-13(9-20)16(23)18-12-3-1-2-4-12/h12-13H,1-11H2,(H,17,21)(H,18,23)
InChIKeyUYUURLSOJFFGCL-UHFFFAOYSA-N
XLogP-1.30
TPSA90.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 5-1.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide 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-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide?
The IUPAC name of N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide (CID 110246700) is N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide is O=C1CN(CC(=O)N2CCOC(C(=O)NC3CCCC3)C2)CCN1.
What is the InChIKey of N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide?
The InChIKey is UYUURLSOJFFGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O4/c21-14-10-19(6-5-17-14)11-15(22)20-7-8-24-13(9-20)16(23)18-12-3-1-2-4-12/h12-13H,1-11H2,(H,17,21)(H,18,23).
What are the key properties of N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide?
N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide has a molecular weight of 338.41 g/mol, XLogP of -1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[2-(3-oxopiperazin-1-yl)acetyl]morpholine-2-carboxamide is sourced from PubChem (CID 110246700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).