1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea

C10H14N6O — CID 47363757

IUPAC1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea
SMILESCc1cc(NC(=O)Nc2cnn(C)c2)n(C)n1
InChIInChI=1S/C10H14N6O/c1-7-4-9(16(3)14-7)13-10(17)12-8-5-11-15(2)6-8/h4-6H,1-3H3,(H2,12,13,17)
InChIKeyNYXIKAAOGRXJFD-UHFFFAOYSA-N
MW234.26 g/mol
LogP1.11
Rot. Bonds2

About 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea

1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea (PubChem CID 47363757) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea.

Molecular Properties

Compound Name1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea
PubChem CID47363757
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea
SMILESCc1cc(NC(=O)Nc2cnn(C)c2)n(C)n1
InChIInChI=1S/C10H14N6O/c1-7-4-9(16(3)14-7)13-10(17)12-8-5-11-15(2)6-8/h4-6H,1-3H3,(H2,12,13,17)
InChIKeyNYXIKAAOGRXJFD-UHFFFAOYSA-N
XLogP1.11
TPSA76.77 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea 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-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea?
The IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea (CID 47363757) is 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea.
What is the SMILES notation for 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea?
The canonical SMILES for 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea is Cc1cc(NC(=O)Nc2cnn(C)c2)n(C)n1.
What is the InChIKey of 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea?
The InChIKey is NYXIKAAOGRXJFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-7-4-9(16(3)14-7)13-10(17)12-8-5-11-15(2)6-8/h4-6H,1-3H3,(H2,12,13,17).
What are the key properties of 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea?
1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea has a molecular weight of 234.26 g/mol, XLogP of 1.11, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea is sourced from PubChem (CID 47363757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).