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

C11H16N2O2 — CID 79159272

IUPAC1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea
SMILESCCN(C)C(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C11H16N2O2/c1-4-12(2)11(15)13(3)9-5-7-10(14)8-6-9/h5-8,14H,4H2,1-3H3
InChIKeyULBHBQWRWYWKJD-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.90
Rot. Bonds2

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

1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea (PubChem CID 79159272) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea.

Molecular Properties

Compound Name1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea
PubChem CID79159272
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea
SMILESCCN(C)C(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C11H16N2O2/c1-4-12(2)11(15)13(3)9-5-7-10(14)8-6-9/h5-8,14H,4H2,1-3H3
InChIKeyULBHBQWRWYWKJD-UHFFFAOYSA-N
XLogP1.90
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-1,3-dimethyl-3-[4-(1,1,2,2,2-pentafluoroethylsulfanyl)phenyl]urea
CID 87737280
1-ethyl-3-(3-fluorophenyl)-1,3-dimethylurea
CID 116655437
2-amino-N-(4-hydroxyphenyl)-N-methylbutanamide
CID 107734416
1-ethyl-1-methyl-3,3-diphenylurea
CID 67018920
1-(4-hydroxyphenyl)-1,3-dimethylurea
CID 115281222
1-(4-cyanophenyl)-3,3-diethyl-1-methylurea
CID 79161464
N-(4-hydroxyphenyl)-N-methyl-2-(methylamino)acetamide
CID 103606278
3-hydroxy-N-(4-hydroxyphenyl)-N,2-dimethylpropanamide
CID 134339239
4-[[(4-hydroxyphenyl)-methylcarbamoyl]-propan-2-ylamino]butanoic acid
CID 107737053
N-(4-hydroxyphenyl)-N-methyl-3-propoxypropanamide
CID 62716161
1,3-bis(4-iodophenyl)-1,3-dimethylurea
CID 101347516
1-(4-hydroxy-N-methylanilino)propan-2-one
CID 12814770

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea?
The IUPAC name of 1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea (CID 79159272) is 1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea.
What is the SMILES notation for 1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea?
The canonical SMILES for 1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea is CCN(C)C(=O)N(C)c1ccc(O)cc1.
What is the InChIKey of 1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea?
The InChIKey is ULBHBQWRWYWKJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-4-12(2)11(15)13(3)9-5-7-10(14)8-6-9/h5-8,14H,4H2,1-3H3.
What are the key properties of 1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea?
1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea has a molecular weight of 208.26 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea is sourced from PubChem (CID 79159272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).