1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea

C15H14Cl2N2O2 — CID 107653706

IUPAC1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea
SMILESCc1cc(NC(=O)Nc2cc(Cl)cc(Cl)c2)c(C)cc1O
InChIInChI=1S/C15H14Cl2N2O2/c1-8-4-14(20)9(2)3-13(8)19-15(21)18-12-6-10(16)5-11(17)7-12/h3-7,20H,1-2H3,(H2,18,19,21)
InChIKeyQFBLYSSDTJQJAX-UHFFFAOYSA-N
MW325.20 g/mol
LogP4.96
Rot. Bonds2

About 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea

1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea (PubChem CID 107653706) has the molecular formula C15H14Cl2N2O2 and a molecular weight of 325.20 g/mol. Its IUPAC name is 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea.

Molecular Properties

Compound Name1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea
PubChem CID107653706
Molecular FormulaC15H14Cl2N2O2
Molecular Weight325.20 g/mol
Exact Mass324.04
IUPAC Name1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea
SMILESCc1cc(NC(=O)Nc2cc(Cl)cc(Cl)c2)c(C)cc1O
InChIInChI=1S/C15H14Cl2N2O2/c1-8-4-14(20)9(2)3-13(8)19-15(21)18-12-6-10(16)5-11(17)7-12/h3-7,20H,1-2H3,(H2,18,19,21)
InChIKeyQFBLYSSDTJQJAX-UHFFFAOYSA-N
XLogP4.96
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.20
LogP ≤ 54.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)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-(2-amino-4,5-dimethylphenyl)-3-(3,5-dichlorophenyl)urea
CID 107653004
3-chloro-N-(4-hydroxy-2,5-dimethylphenyl)-5-methylbenzamide
CID 106834998
1-(3,5-dichlorophenyl)-3-(2,6-dimethylphenyl)urea
CID 108991412
1-(4-amino-2,6-dimethylphenyl)-3-(3,5-dichlorophenyl)urea
CID 107653033
1-(2-amino-4-methylphenyl)-3-(3,5-dichlorophenyl)urea
CID 107652937
1-(3-amino-4-methylphenyl)-3-(3,5-dichlorophenyl)urea
CID 107652923
1-(3,5-dichlorophenyl)-3-(2-ethylphenyl)urea
CID 108991481
5-chloro-N-(4-hydroxy-2,5-dimethylphenyl)pyridine-2-carboxamide
CID 106834852
4-[(3,5-dichlorophenyl)carbamoylamino]-2-methyl-1H-pyrrole-3-carboxylic acid
CID 107653108
1-(3,5-dibromophenyl)-3-(3,5-dichlorophenyl)urea
CID 175721758
1-(3-bromo-5-chlorophenyl)-3-(3,5-dichlorophenyl)urea
CID 172725439
2-bromo-5-chloro-N-(4-hydroxy-2,5-dimethylphenyl)benzamide
CID 106834696

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea?
The IUPAC name of 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea (CID 107653706) is 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea.
What is the SMILES notation for 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea?
The canonical SMILES for 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea is Cc1cc(NC(=O)Nc2cc(Cl)cc(Cl)c2)c(C)cc1O.
What is the InChIKey of 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea?
The InChIKey is QFBLYSSDTJQJAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O2/c1-8-4-14(20)9(2)3-13(8)19-15(21)18-12-6-10(16)5-11(17)7-12/h3-7,20H,1-2H3,(H2,18,19,21).
What are the key properties of 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea?
1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea has a molecular weight of 325.20 g/mol, XLogP of 4.96, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichlorophenyl)-3-(4-hydroxy-2,5-dimethylphenyl)urea is sourced from PubChem (CID 107653706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).