3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea

C10H18N4O — CID 78951288

IUPAC3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea
SMILESCCN(CC)C(=O)Nc1c(C)n[nH]c1C
InChIInChI=1S/C10H18N4O/c1-5-14(6-2)10(15)11-9-7(3)12-13-8(9)4/h5-6H2,1-4H3,(H,11,15)(H,12,13)
InChIKeyLGENPOCPMJKKJG-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.90
Rot. Bonds3

About 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea

3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea (PubChem CID 78951288) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea.

Molecular Properties

Compound Name3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea
PubChem CID78951288
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea
SMILESCCN(CC)C(=O)Nc1c(C)n[nH]c1C
InChIInChI=1S/C10H18N4O/c1-5-14(6-2)10(15)11-9-7(3)12-13-8(9)4/h5-6H2,1-4H3,(H,11,15)(H,12,13)
InChIKeyLGENPOCPMJKKJG-UHFFFAOYSA-N
XLogP1.90
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea 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

3-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl-ethylamino]propanoic acid
CID 61202435
2-[[2-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]-2-oxoethyl]-ethylamino]acetic acid
CID 54900293
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylbutanamide
CID 43546964
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 43582921
4-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]-4-oxobutanoic acid
CID 16645428
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide
CID 126991153
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-ethylthiophene-2-carboxamide
CID 61389198
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-hydroxyethyl(methyl)amino]acetamide
CID 60683878
(2R,3R)-2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-methylpentanamide
CID 93240679
1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-ethylthiourea
CID 5270685
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
CID 43547720
1-tert-butyl-3-(3,5-dimethyl-1H-pyrazol-4-yl)urea
CID 43547022

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea?
The IUPAC name of 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea (CID 78951288) is 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea.
What is the SMILES notation for 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea?
The canonical SMILES for 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea is CCN(CC)C(=O)Nc1c(C)n[nH]c1C.
What is the InChIKey of 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea?
The InChIKey is LGENPOCPMJKKJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-5-14(6-2)10(15)11-9-7(3)12-13-8(9)4/h5-6H2,1-4H3,(H,11,15)(H,12,13).
What are the key properties of 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea?
3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea has a molecular weight of 210.28 g/mol, XLogP of 1.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethyl-1H-pyrazol-4-yl)-1,1-diethylurea is sourced from PubChem (CID 78951288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).