1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea

C17H20N2O2 — CID 110895839

IUPAC1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea
SMILESCCc1ccccc1NC(=O)NC(CO)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-2-13-8-6-7-11-15(13)18-17(21)19-16(12-20)14-9-4-3-5-10-14/h3-11,16,20H,2,12H2,1H3,(H2,18,19,21)
InChIKeyDMNWKDXMMNNUOR-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.10
Rot. Bonds5

About 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea

1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea (PubChem CID 110895839) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea.

Molecular Properties

Compound Name1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea
PubChem CID110895839
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea
SMILESCCc1ccccc1NC(=O)NC(CO)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-2-13-8-6-7-11-15(13)18-17(21)19-16(12-20)14-9-4-3-5-10-14/h3-11,16,20H,2,12H2,1H3,(H2,18,19,21)
InChIKeyDMNWKDXMMNNUOR-UHFFFAOYSA-N
XLogP3.10
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide
CID 111798095
1-(2-fluorophenyl)-3-[(1R)-2-hydroxy-1-phenylethyl]urea
CID 103765021
1-(3-fluoro-2-methylphenyl)-3-(2-hydroxy-1-phenylethyl)urea
CID 111521359
1-[2-(difluoromethoxy)phenyl]-3-(2-hydroxy-1-phenylethyl)urea
CID 110895833
1-[(1R)-2-hydroxy-1-phenylethyl]-3-propan-2-ylurea
CID 103763270
3-amino-N-(2-ethylphenyl)-2-phenylpropanamide
CID 62878156
(2S)-2-chloro-N-(2-ethylphenyl)-2-phenylacetamide
CID 40554368
(2R)-2-chloro-N-(2-ethylphenyl)-2-phenylacetamide
CID 40554367
1-(4-bromophenyl)-3-(2-hydroxy-1-phenylethyl)urea
CID 71655407
1-butyl-3-[(1R)-2-hydroxy-1-phenylethyl]urea
CID 94740192
(2S)-2-[(2-ethylphenyl)carbamoylamino]-3-phenylpropanoate
CID 7602326
1-(2-hydroxy-1-phenylethyl)-3-[1-(2-methylphenyl)propan-2-yl]urea
CID 110901372

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea?
The IUPAC name of 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea (CID 110895839) is 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea.
What is the SMILES notation for 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea?
The canonical SMILES for 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea is CCc1ccccc1NC(=O)NC(CO)c1ccccc1.
What is the InChIKey of 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea?
The InChIKey is DMNWKDXMMNNUOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-2-13-8-6-7-11-15(13)18-17(21)19-16(12-20)14-9-4-3-5-10-14/h3-11,16,20H,2,12H2,1H3,(H2,18,19,21).
What are the key properties of 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea?
1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea has a molecular weight of 284.36 g/mol, XLogP of 3.10, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea is sourced from PubChem (CID 110895839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).