1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea

C10H7N5O2 — CID 154706654

IUPAC1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea
SMILESN#Cc1coc(NC(=O)Nc2cccnc2)n1
InChIInChI=1S/C10H7N5O2/c11-4-8-6-17-10(14-8)15-9(16)13-7-2-1-3-12-5-7/h1-3,5-6H,(H2,13,14,15,16)
InChIKeyLUSQWUWPNLLQAK-UHFFFAOYSA-N
MW229.20 g/mol
LogP1.59
Rot. Bonds2

About 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea

1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea (PubChem CID 154706654) has the molecular formula C10H7N5O2 and a molecular weight of 229.20 g/mol. Its IUPAC name is 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea.

Molecular Properties

Compound Name1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea
PubChem CID154706654
Molecular FormulaC10H7N5O2
Molecular Weight229.20 g/mol
Exact Mass229.06
IUPAC Name1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea
SMILESN#Cc1coc(NC(=O)Nc2cccnc2)n1
InChIInChI=1S/C10H7N5O2/c11-4-8-6-17-10(14-8)15-9(16)13-7-2-1-3-12-5-7/h1-3,5-6H,(H2,13,14,15,16)
InChIKeyLUSQWUWPNLLQAK-UHFFFAOYSA-N
XLogP1.59
TPSA103.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.20
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-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-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea?
The IUPAC name of 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea (CID 154706654) is 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea.
What is the SMILES notation for 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea?
The canonical SMILES for 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea is N#Cc1coc(NC(=O)Nc2cccnc2)n1.
What is the InChIKey of 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea?
The InChIKey is LUSQWUWPNLLQAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N5O2/c11-4-8-6-17-10(14-8)15-9(16)13-7-2-1-3-12-5-7/h1-3,5-6H,(H2,13,14,15,16).
What are the key properties of 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea?
1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea has a molecular weight of 229.20 g/mol, XLogP of 1.59, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyano-1,3-oxazol-2-yl)-3-pyridin-3-ylurea is sourced from PubChem (CID 154706654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).