1-hydroxy-1-(2-phenylethyl)urea

C9H12N2O2 — CID 10241398

IUPAC1-hydroxy-1-(2-phenylethyl)urea
SMILESNC(=O)N(O)CCc1ccccc1
InChIInChI=1S/C9H12N2O2/c10-9(12)11(13)7-6-8-4-2-1-3-5-8/h1-5,13H,6-7H2,(H2,10,12)
InChIKeyBYGLPZGZMLKJDU-UHFFFAOYSA-N
MW180.21 g/mol
LogP1.00
Rot. Bonds3

About 1-hydroxy-1-(2-phenylethyl)urea

1-hydroxy-1-(2-phenylethyl)urea (PubChem CID 10241398) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is 1-hydroxy-1-(2-phenylethyl)urea.

Molecular Properties

Compound Name1-hydroxy-1-(2-phenylethyl)urea
PubChem CID10241398
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name1-hydroxy-1-(2-phenylethyl)urea
SMILESNC(=O)N(O)CCc1ccccc1
InChIInChI=1S/C9H12N2O2/c10-9(12)11(13)7-6-8-4-2-1-3-5-8/h1-5,13H,6-7H2,(H2,10,12)
InChIKeyBYGLPZGZMLKJDU-UHFFFAOYSA-N
XLogP1.00
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 51.00
H-Bond Donors ≤ 52
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'}

Analyze 1-hydroxy-1-(2-phenylethyl)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

hydroxy(2-phenylethyl)carbamic acid
CID 87254387
1-amino-1-(4-phenylbutyl)urea
CID 170908979
2-[methyl(2-phenylethyl)amino]propanamide
CID 47280413
N',N'-bis(2-phenylethyl)butanediamide
CID 70184693
N-hydroxy-N-(2-phenylethyl)formamide
CID 87396822
(2R)-2-amino-N-methyl-N-(2-phenylethyl)propanamide
CID 78973247
N,N-diamino-2-phenylethanamine
CID 18409381
3-carbamoyl-1-methyl-1-(2-phenylethyl)urea
CID 23220
carbonic acid;3-phenylpropanamide
CID 174965682
1-methyl-1-(2-phenylethyl)hydrazine;hydrochloride
CID 46929951
N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide
CID 19761862
(2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide
CID 78973061

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-(2-phenylethyl)urea?
The IUPAC name of 1-hydroxy-1-(2-phenylethyl)urea (CID 10241398) is 1-hydroxy-1-(2-phenylethyl)urea.
What is the SMILES notation for 1-hydroxy-1-(2-phenylethyl)urea?
The canonical SMILES for 1-hydroxy-1-(2-phenylethyl)urea is NC(=O)N(O)CCc1ccccc1.
What is the InChIKey of 1-hydroxy-1-(2-phenylethyl)urea?
The InChIKey is BYGLPZGZMLKJDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c10-9(12)11(13)7-6-8-4-2-1-3-5-8/h1-5,13H,6-7H2,(H2,10,12).
What are the key properties of 1-hydroxy-1-(2-phenylethyl)urea?
1-hydroxy-1-(2-phenylethyl)urea has a molecular weight of 180.21 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-(2-phenylethyl)urea is sourced from PubChem (CID 10241398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).