N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide

C15H17N3O4 — CID 67785873

IUPACN-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESO=C1C=Cc2nc(CCNC(=O)CN3CCCC3=O)oc2C1
InChIInChI=1S/C15H17N3O4/c19-10-3-4-11-12(8-10)22-14(17-11)5-6-16-13(20)9-18-7-1-2-15(18)21/h3-4H,1-2,5-9H2,(H,16,20)
InChIKeySWCJPQUFTCBZFD-UHFFFAOYSA-N
MW303.32 g/mol
LogP0.09
Rot. Bonds5

About N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide

N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 67785873) has the molecular formula C15H17N3O4 and a molecular weight of 303.32 g/mol. Its IUPAC name is N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID67785873
Molecular FormulaC15H17N3O4
Molecular Weight303.32 g/mol
Exact Mass303.12
IUPAC NameN-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESO=C1C=Cc2nc(CCNC(=O)CN3CCCC3=O)oc2C1
InChIInChI=1S/C15H17N3O4/c19-10-3-4-11-12(8-10)22-14(17-11)5-6-16-13(20)9-18-7-1-2-15(18)21/h3-4H,1-2,5-9H2,(H,16,20)
InChIKeySWCJPQUFTCBZFD-UHFFFAOYSA-N
XLogP0.09
TPSA92.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-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-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide (CID 67785873) is N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide is O=C1C=Cc2nc(CCNC(=O)CN3CCCC3=O)oc2C1.
What is the InChIKey of N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is SWCJPQUFTCBZFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O4/c19-10-3-4-11-12(8-10)22-14(17-11)5-6-16-13(20)9-18-7-1-2-15(18)21/h3-4H,1-2,5-9H2,(H,16,20).
What are the key properties of N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 303.32 g/mol, XLogP of 0.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-oxo-7H-1,3-benzoxazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 67785873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).