1-hydroxy-3-(3-methylphenyl)urea

C8H10N2O2 — CID 10034960

IUPAC1-hydroxy-3-(3-methylphenyl)urea
SMILESCc1cccc(NC(=O)NO)c1
InChIInChI=1S/C8H10N2O2/c1-6-3-2-4-7(5-6)9-8(11)10-12/h2-5,12H,1H3,(H2,9,10,11)
InChIKeyNWFZHUXUUHGSJJ-UHFFFAOYSA-N
MW166.18 g/mol
LogP1.51
Rot. Bonds1

About 1-hydroxy-3-(3-methylphenyl)urea

1-hydroxy-3-(3-methylphenyl)urea (PubChem CID 10034960) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 1-hydroxy-3-(3-methylphenyl)urea.

Molecular Properties

Compound Name1-hydroxy-3-(3-methylphenyl)urea
PubChem CID10034960
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name1-hydroxy-3-(3-methylphenyl)urea
SMILESCc1cccc(NC(=O)NO)c1
InChIInChI=1S/C8H10N2O2/c1-6-3-2-4-7(5-6)9-8(11)10-12/h2-5,12H,1H3,(H2,9,10,11)
InChIKeyNWFZHUXUUHGSJJ-UHFFFAOYSA-N
XLogP1.51
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(3-methylphenyl)-3-(4-methylphenyl)urea
CID 12560219
N-(3-methylphenyl)acetamide
CID 10843
ethane;1-(3-methylphenyl)-3-(4-methylphenyl)urea
CID 144571774
1-(3-methylphenyl)-3-[4-[4-[(3-methylphenyl)carbamoylamino]phenyl]phenyl]urea
CID 1239967
1-(3,4-dimethylphenyl)-3-(3-methylphenyl)urea
CID 2985670
1,3-bis[(3-methylphenyl)carbamothioylamino]urea
CID 2823948
1-cyclopropyl-3-(3-methylphenyl)urea
CID 841579
2-[(3-methylphenyl)carbamoylamino]acetamide
CID 47122532
1-(3-chloro-4-methylphenyl)-3-(3-methylphenyl)urea
CID 727838
1-benzamido-3-(3-methylphenyl)urea
CID 19798346
1-(2-bromo-3-chlorophenyl)-3-(3-methylphenyl)urea
CID 103480099
2,5-dimethyl-N-(3-methylphenyl)benzamide
CID 925357

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-3-(3-methylphenyl)urea?
The IUPAC name of 1-hydroxy-3-(3-methylphenyl)urea (CID 10034960) is 1-hydroxy-3-(3-methylphenyl)urea.
What is the SMILES notation for 1-hydroxy-3-(3-methylphenyl)urea?
The canonical SMILES for 1-hydroxy-3-(3-methylphenyl)urea is Cc1cccc(NC(=O)NO)c1.
What is the InChIKey of 1-hydroxy-3-(3-methylphenyl)urea?
The InChIKey is NWFZHUXUUHGSJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-6-3-2-4-7(5-6)9-8(11)10-12/h2-5,12H,1H3,(H2,9,10,11).
What are the key properties of 1-hydroxy-3-(3-methylphenyl)urea?
1-hydroxy-3-(3-methylphenyl)urea has a molecular weight of 166.18 g/mol, XLogP of 1.51, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3-(3-methylphenyl)urea is sourced from PubChem (CID 10034960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).