1-amino-3-(3-hydroxyphenyl)urea

C7H9N3O2 — CID 23273555

IUPAC1-amino-3-(3-hydroxyphenyl)urea
SMILESNNC(=O)Nc1cccc(O)c1
InChIInChI=1S/C7H9N3O2/c8-10-7(12)9-5-2-1-3-6(11)4-5/h1-4,11H,8H2,(H2,9,10,12)
InChIKeyKFUOITNHUWTODG-UHFFFAOYSA-N
MW167.17 g/mol
LogP0.39
Rot. Bonds1

About 1-amino-3-(3-hydroxyphenyl)urea

1-amino-3-(3-hydroxyphenyl)urea (PubChem CID 23273555) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is 1-amino-3-(3-hydroxyphenyl)urea.

Molecular Properties

Compound Name1-amino-3-(3-hydroxyphenyl)urea
PubChem CID23273555
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name1-amino-3-(3-hydroxyphenyl)urea
SMILESNNC(=O)Nc1cccc(O)c1
InChIInChI=1S/C7H9N3O2/c8-10-7(12)9-5-2-1-3-6(11)4-5/h1-4,11H,8H2,(H2,9,10,12)
InChIKeyKFUOITNHUWTODG-UHFFFAOYSA-N
XLogP0.39
TPSA87.38 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 50.39
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-amino-3-(3-hydroxyphenyl)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

N-[3-(hydrazinecarbonylamino)phenyl]acetamide
CID 82283644
N-[4-[(3-hydroxyphenyl)carbamoylamino]phenyl]acetamide
CID 108895676
1-(3-hydroxyphenyl)-3-[6-[(3-hydroxyphenyl)carbamoylamino]hexyl]urea
CID 71353515
1-(3-hydroxyphenyl)-3-pyrimidin-2-ylurea
CID 108895771
N,N'-bis(3-hydroxyphenyl)but-2-enediamide
CID 754651
2-(3-hydroxyanilino)acetohydrazide
CID 132888164
1-(3-hydroxyphenyl)-3-(3-nitrophenyl)urea
CID 28540569
2,2-difluoro-N-(3-hydroxyphenyl)acetamide
CID 103600554
1-amino-3-(3-pyrimidin-5-ylphenyl)urea
CID 142783216
1-(3-hydroxyphenyl)-3-(3-oxobutyl)urea
CID 108894947
1-(3-hydroxyphenyl)-3-[4-(methanesulfonamido)phenyl]urea
CID 108875136
methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate
CID 108895907

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(3-hydroxyphenyl)urea?
The IUPAC name of 1-amino-3-(3-hydroxyphenyl)urea (CID 23273555) is 1-amino-3-(3-hydroxyphenyl)urea.
What is the SMILES notation for 1-amino-3-(3-hydroxyphenyl)urea?
The canonical SMILES for 1-amino-3-(3-hydroxyphenyl)urea is NNC(=O)Nc1cccc(O)c1.
What is the InChIKey of 1-amino-3-(3-hydroxyphenyl)urea?
The InChIKey is KFUOITNHUWTODG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c8-10-7(12)9-5-2-1-3-6(11)4-5/h1-4,11H,8H2,(H2,9,10,12).
What are the key properties of 1-amino-3-(3-hydroxyphenyl)urea?
1-amino-3-(3-hydroxyphenyl)urea has a molecular weight of 167.17 g/mol, XLogP of 0.39, 1 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(3-hydroxyphenyl)urea is sourced from PubChem (CID 23273555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).