N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide

C15H14N4O2 — CID 121198831

IUPACN-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide
SMILESO=C(Cn1cccc1)NCc1nccnc1-c1ccco1
InChIInChI=1S/C15H14N4O2/c20-14(11-19-7-1-2-8-19)18-10-12-15(17-6-5-16-12)13-4-3-9-21-13/h1-9H,10-11H2,(H,18,20)
InChIKeyHUIIBJRBTOXWEU-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.85
Rot. Bonds5

About N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide

N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide (PubChem CID 121198831) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide.

Molecular Properties

Compound NameN-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide
PubChem CID121198831
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC NameN-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide
SMILESO=C(Cn1cccc1)NCc1nccnc1-c1ccco1
InChIInChI=1S/C15H14N4O2/c20-14(11-19-7-1-2-8-19)18-10-12-15(17-6-5-16-12)13-4-3-9-21-13/h1-9H,10-11H2,(H,18,20)
InChIKeyHUIIBJRBTOXWEU-UHFFFAOYSA-N
XLogP1.85
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide?
The IUPAC name of N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide (CID 121198831) is N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide.
What is the SMILES notation for N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide?
The canonical SMILES for N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide is O=C(Cn1cccc1)NCc1nccnc1-c1ccco1.
What is the InChIKey of N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide?
The InChIKey is HUIIBJRBTOXWEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c20-14(11-19-7-1-2-8-19)18-10-12-15(17-6-5-16-12)13-4-3-9-21-13/h1-9H,10-11H2,(H,18,20).
What are the key properties of N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide?
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide has a molecular weight of 282.30 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide is sourced from PubChem (CID 121198831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).