1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea

C18H22N2O3 — CID 111431297

IUPAC1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea
SMILESCN(CCO)C(=O)Nc1ccccc1OCCc1ccccc1
InChIInChI=1S/C18H22N2O3/c1-20(12-13-21)18(22)19-16-9-5-6-10-17(16)23-14-11-15-7-3-2-4-8-15/h2-10,21H,11-14H2,1H3,(H,19,22)
InChIKeyCMXPWWWYDLYSGZ-UHFFFAOYSA-N
MW314.38 g/mol
LogP2.76
Rot. Bonds7

About 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea

1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea (PubChem CID 111431297) has the molecular formula C18H22N2O3 and a molecular weight of 314.38 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea
PubChem CID111431297
Molecular FormulaC18H22N2O3
Molecular Weight314.38 g/mol
Exact Mass314.16
IUPAC Name1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea
SMILESCN(CCO)C(=O)Nc1ccccc1OCCc1ccccc1
InChIInChI=1S/C18H22N2O3/c1-20(12-13-21)18(22)19-16-9-5-6-10-17(16)23-14-11-15-7-3-2-4-8-15/h2-10,21H,11-14H2,1H3,(H,19,22)
InChIKeyCMXPWWWYDLYSGZ-UHFFFAOYSA-N
XLogP2.76
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]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-methyl-3-[2-(2-phenylethoxy)phenyl]urea
CID 47033729
1-(2-hydroxyethyl)-1-methyl-3-(4-methyl-2-phenylmethoxyphenyl)urea
CID 111431455
1-(2-hydroxyethyl)-1-methyl-3-[2-(4-methylphenoxy)phenyl]urea
CID 111105100
3-[methyl-[[2-[(2-methylpropan-2-yl)oxy]phenyl]carbamoyl]amino]propanoic acid
CID 122084828
methyl 2-[[methyl(2-phenylethyl)carbamoyl]amino]benzoate
CID 23734523
2-(dipropylamino)-N-[2-(3-phenylpropoxy)phenyl]acetamide
CID 54818625
N-[2-(2-phenylethoxy)phenyl]-1H-indole-2-carboxamide
CID 55675130
2-(methylamino)-N-[2-(3-phenylpropoxy)phenyl]acetamide
CID 54820711
3-(2-methoxyphenyl)-1-methyl-1-(2-pyridin-2-ylethyl)urea
CID 16612937
2-(2-formylphenoxy)-N-[2-(2-phenylethoxy)phenyl]acetamide
CID 60513932
N-[2-(2-phenylethoxy)phenyl]-2-(trifluoromethylsulfanyl)acetamide
CID 55675133
2-methyl-N-[2-(2-phenylethoxy)phenyl]pyrimidine-4-carboxamide
CID 51122601

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea?
The IUPAC name of 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea (CID 111431297) is 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea.
What is the SMILES notation for 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea?
The canonical SMILES for 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea is CN(CCO)C(=O)Nc1ccccc1OCCc1ccccc1.
What is the InChIKey of 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea?
The InChIKey is CMXPWWWYDLYSGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-20(12-13-21)18(22)19-16-9-5-6-10-17(16)23-14-11-15-7-3-2-4-8-15/h2-10,21H,11-14H2,1H3,(H,19,22).
What are the key properties of 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea?
1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea has a molecular weight of 314.38 g/mol, XLogP of 2.76, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-1-methyl-3-[2-(2-phenylethoxy)phenyl]urea is sourced from PubChem (CID 111431297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).