1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea

C15H24N2O3 — CID 114943941

IUPAC1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea
SMILESCCOC(C)(C)CNC(=O)Nc1ccc(C(C)O)cc1
InChIInChI=1S/C15H24N2O3/c1-5-20-15(3,4)10-16-14(19)17-13-8-6-12(7-9-13)11(2)18/h6-9,11,18H,5,10H2,1-4H3,(H2,16,17,19)
InChIKeyGCJBLPQUYFVVJF-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.68
Rot. Bonds6

About 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea

1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea (PubChem CID 114943941) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea.

Molecular Properties

Compound Name1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea
PubChem CID114943941
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea
SMILESCCOC(C)(C)CNC(=O)Nc1ccc(C(C)O)cc1
InChIInChI=1S/C15H24N2O3/c1-5-20-15(3,4)10-16-14(19)17-13-8-6-12(7-9-13)11(2)18/h6-9,11,18H,5,10H2,1-4H3,(H2,16,17,19)
InChIKeyGCJBLPQUYFVVJF-UHFFFAOYSA-N
XLogP2.68
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)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-[4-(1-aminoethyl)phenyl]-3-(2-ethoxy-2-methylpropyl)urea
CID 114943944
ethyl 2-[[4-(1-hydroxyethyl)phenyl]carbamoylamino]acetate
CID 61340701
1-[4-(1-hydroxyethyl)phenyl]-3-(2,2,2-trifluoroethyl)urea
CID 61347612
1-[3-(dimethylamino)-2,2-dimethylpropyl]-3-[4-(1-hydroxyethyl)phenyl]urea
CID 61341241
1-[4-(1-hydroxyethyl)phenyl]-3-[2-[methyl(propan-2-yl)amino]ethyl]urea
CID 62641101
1-[4-(1-hydroxyethyl)phenyl]-3-(3-propoxypropyl)urea
CID 82946717
1-(2,2-dimethylpropyl)-3-[4-[1-(methylamino)ethyl]phenyl]urea
CID 61341881
2-hydroxy-2-methyl-3-[(4-propan-2-ylphenyl)carbamoylamino]propanoic acid
CID 66174047
1-[4-(1-hydroxyethyl)phenyl]-3-(2-sulfamoylethyl)urea
CID 61342170
1-ethyl-3-(4-propan-2-ylphenyl)urea
CID 4647135
1-(2-methyl-2-phenylpropyl)-3-(4-propan-2-ylphenyl)urea
CID 113213273
1-[4-(1-aminoethyl)phenyl]-3-(2-methyl-2-methylsulfonylpropyl)urea
CID 79558826

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea?
The IUPAC name of 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea (CID 114943941) is 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea.
What is the SMILES notation for 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea?
The canonical SMILES for 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea is CCOC(C)(C)CNC(=O)Nc1ccc(C(C)O)cc1.
What is the InChIKey of 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea?
The InChIKey is GCJBLPQUYFVVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-5-20-15(3,4)10-16-14(19)17-13-8-6-12(7-9-13)11(2)18/h6-9,11,18H,5,10H2,1-4H3,(H2,16,17,19).
What are the key properties of 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea?
1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea has a molecular weight of 280.37 g/mol, XLogP of 2.68, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxy-2-methylpropyl)-3-[4-(1-hydroxyethyl)phenyl]urea is sourced from PubChem (CID 114943941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).