1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea

C14H18N4O — CID 108813453

IUPAC1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea
SMILESCCc1ccccc1NC(=O)Nc1cc(C)n(C)n1
InChIInChI=1S/C14H18N4O/c1-4-11-7-5-6-8-12(11)15-14(19)16-13-9-10(2)18(3)17-13/h5-9H,4H2,1-3H3,(H2,15,16,17,19)
InChIKeyMUXIKASRYJDFEG-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.93
Rot. Bonds3

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

1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea (PubChem CID 108813453) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea.

Molecular Properties

Compound Name1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea
PubChem CID108813453
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea
SMILESCCc1ccccc1NC(=O)Nc1cc(C)n(C)n1
InChIInChI=1S/C14H18N4O/c1-4-11-7-5-6-8-12(11)15-14(19)16-13-9-10(2)18(3)17-13/h5-9H,4H2,1-3H3,(H2,15,16,17,19)
InChIKeyMUXIKASRYJDFEG-UHFFFAOYSA-N
XLogP2.93
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1,5-dimethylpyrazol-3-yl)-3-[[2-(2,2,2-trifluoroethyl)phenyl]methyl]urea
CID 126826794
1-(1,5-dimethylpyrazol-3-yl)-3-(2-phenyl-5-propylsulfonylphenyl)urea
CID 158610459
1-tert-butyl-3-(1,5-dimethylpyrazol-3-yl)urea
CID 108813276
2-bromo-N-(1,5-dimethylpyrazol-3-yl)acetamide
CID 130496766
N-(1,5-dimethylpyrazol-3-yl)-3-phenylpropanamide
CID 35761194
N-(2-ethylphenyl)-1,2,5-trimethylpyrrole-3-carboxamide
CID 125145143
4-[(1,5-dimethylpyrazol-3-yl)carbamoylamino]benzoic acid
CID 108813242
1-(3,5-dimethylphenyl)-3-(2-ethylphenyl)urea
CID 108991353
2-bromo-N-(1,5-dimethylpyrazol-3-yl)butanamide
CID 130496769
3-amino-N-(2-ethylphenyl)-1-methylpyrazole-5-carboxamide
CID 122171276
1-(2,5-dimethylphenyl)-3-(2-ethylphenyl)urea
CID 17270131
N-(2-ethylphenyl)-1,3-dimethylthieno[3,2-d]pyrazole-5-carboxamide
CID 51304599

Frequently Asked Questions

What is the IUPAC name of 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea?
The IUPAC name of 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea (CID 108813453) is 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea.
What is the SMILES notation for 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea?
The canonical SMILES for 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea is CCc1ccccc1NC(=O)Nc1cc(C)n(C)n1.
What is the InChIKey of 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea?
The InChIKey is MUXIKASRYJDFEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-4-11-7-5-6-8-12(11)15-14(19)16-13-9-10(2)18(3)17-13/h5-9H,4H2,1-3H3,(H2,15,16,17,19).
What are the key properties of 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea?
1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea has a molecular weight of 258.32 g/mol, XLogP of 2.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,5-dimethylpyrazol-3-yl)-3-(2-ethylphenyl)urea is sourced from PubChem (CID 108813453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).