1-(4-hydroxyphenyl)-1,3-dimethylurea

C9H12N2O2 — CID 115281222

IUPAC1-(4-hydroxyphenyl)-1,3-dimethylurea
SMILESCNC(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C9H12N2O2/c1-10-9(13)11(2)7-3-5-8(12)6-4-7/h3-6,12H,1-2H3,(H,10,13)
InChIKeyQOLREYPRBXZBDI-UHFFFAOYSA-N
MW180.21 g/mol
LogP1.17
Rot. Bonds1

About 1-(4-hydroxyphenyl)-1,3-dimethylurea

1-(4-hydroxyphenyl)-1,3-dimethylurea (PubChem CID 115281222) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)-1,3-dimethylurea.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)-1,3-dimethylurea
PubChem CID115281222
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name1-(4-hydroxyphenyl)-1,3-dimethylurea
SMILESCNC(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C9H12N2O2/c1-10-9(13)11(2)7-3-5-8(12)6-4-7/h3-6,12H,1-2H3,(H,10,13)
InChIKeyQOLREYPRBXZBDI-UHFFFAOYSA-N
XLogP1.17
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(4-hydroxyphenyl)-1,3-dimethylurea 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-(4-methoxyphenyl)-1,3-dimethylurea
CID 116655338
3-(3,5-dihydroxyphenyl)-1-(4-hydroxyphenyl)-1-methylurea
CID 108895520
N-(4-hydroxyphenyl)-N-methyl-2-(methylamino)acetamide
CID 103606278
1,3-dimethyl-1-(4-propan-2-yloxyphenyl)urea
CID 115169003
3-(4-chlorophenyl)-1-(4-hydroxyphenyl)-1-methylurea
CID 28740219
2-[[(4-hydroxyphenyl)-methylcarbamoyl]amino]butanedioic acid
CID 107736952
1-(4-hydroxyphenyl)-1-methyl-3-(phenoxymethyl)urea
CID 108888950
1-(4-hydroxyphenyl)-1-methyl-3-[(E)-2-phenylethenyl]urea
CID 108903288
1-[[[(4-hydroxyphenyl)-methylcarbamoyl]amino]methyl]cyclopropane-1-carboxylic acid
CID 107736885
1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea
CID 79159272
2-chloro-N-(4-hydroxyphenyl)-N-methylpropanamide
CID 11063778
2-amino-N-(4-hydroxyphenyl)-N-methylpropanamide
CID 23221170

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)-1,3-dimethylurea?
The IUPAC name of 1-(4-hydroxyphenyl)-1,3-dimethylurea (CID 115281222) is 1-(4-hydroxyphenyl)-1,3-dimethylurea.
What is the SMILES notation for 1-(4-hydroxyphenyl)-1,3-dimethylurea?
The canonical SMILES for 1-(4-hydroxyphenyl)-1,3-dimethylurea is CNC(=O)N(C)c1ccc(O)cc1.
What is the InChIKey of 1-(4-hydroxyphenyl)-1,3-dimethylurea?
The InChIKey is QOLREYPRBXZBDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c1-10-9(13)11(2)7-3-5-8(12)6-4-7/h3-6,12H,1-2H3,(H,10,13).
What are the key properties of 1-(4-hydroxyphenyl)-1,3-dimethylurea?
1-(4-hydroxyphenyl)-1,3-dimethylurea has a molecular weight of 180.21 g/mol, XLogP of 1.17, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)-1,3-dimethylurea is sourced from PubChem (CID 115281222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).