2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide

C15H18N4O2 — CID 51076151

IUPAC2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide
SMILESCOCC(=O)Nc1nc2ccccc2nc1N1CCCC1
InChIInChI=1S/C15H18N4O2/c1-21-10-13(20)18-14-15(19-8-4-5-9-19)17-12-7-3-2-6-11(12)16-14/h2-3,6-7H,4-5,8-10H2,1H3,(H,16,18,20)
InChIKeyGDPDPCWAJVARNI-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.81
Rot. Bonds4

About 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide

2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide (PubChem CID 51076151) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide.

Molecular Properties

Compound Name2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide
PubChem CID51076151
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide
SMILESCOCC(=O)Nc1nc2ccccc2nc1N1CCCC1
InChIInChI=1S/C15H18N4O2/c1-21-10-13(20)18-14-15(19-8-4-5-9-19)17-12-7-3-2-6-11(12)16-14/h2-3,6-7H,4-5,8-10H2,1H3,(H,16,18,20)
InChIKeyGDPDPCWAJVARNI-UHFFFAOYSA-N
XLogP1.81
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide?
The IUPAC name of 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide (CID 51076151) is 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide.
What is the SMILES notation for 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide?
The canonical SMILES for 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide is COCC(=O)Nc1nc2ccccc2nc1N1CCCC1.
What is the InChIKey of 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide?
The InChIKey is GDPDPCWAJVARNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-21-10-13(20)18-14-15(19-8-4-5-9-19)17-12-7-3-2-6-11(12)16-14/h2-3,6-7H,4-5,8-10H2,1H3,(H,16,18,20).
What are the key properties of 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide?
2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide has a molecular weight of 286.34 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide is sourced from PubChem (CID 51076151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).