1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea

C13H14N4O2 — CID 6466915

IUPAC1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea
SMILESCCOc1ccccc1NC(=O)Nc1cnccn1
InChIInChI=1S/C13H14N4O2/c1-2-19-11-6-4-3-5-10(11)16-13(18)17-12-9-14-7-8-15-12/h3-9H,2H2,1H3,(H2,15,16,17,18)
InChIKeyHPEBQUZNOSPDJE-UHFFFAOYSA-N
MW258.28 g/mol
LogP2.52
Rot. Bonds4

About 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea

1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea (PubChem CID 6466915) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea
PubChem CID6466915
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea
SMILESCCOc1ccccc1NC(=O)Nc1cnccn1
InChIInChI=1S/C13H14N4O2/c1-2-19-11-6-4-3-5-10(11)16-13(18)17-12-9-14-7-8-15-12/h3-9H,2H2,1H3,(H2,15,16,17,18)
InChIKeyHPEBQUZNOSPDJE-UHFFFAOYSA-N
XLogP2.52
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea 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 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea?
The IUPAC name of 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea (CID 6466915) is 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea.
What is the SMILES notation for 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea?
The canonical SMILES for 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea is CCOc1ccccc1NC(=O)Nc1cnccn1.
What is the InChIKey of 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea?
The InChIKey is HPEBQUZNOSPDJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-2-19-11-6-4-3-5-10(11)16-13(18)17-12-9-14-7-8-15-12/h3-9H,2H2,1H3,(H2,15,16,17,18).
What are the key properties of 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea?
1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea has a molecular weight of 258.28 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-3-pyrazin-2-ylurea is sourced from PubChem (CID 6466915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).