1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea

C17H20N2O2 — CID 61348000

IUPAC1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea
SMILESCCc1cccc(NC(=O)Nc2ccc(C(C)O)cc2)c1
InChIInChI=1S/C17H20N2O2/c1-3-13-5-4-6-16(11-13)19-17(21)18-15-9-7-14(8-10-15)12(2)20/h4-12,20H,3H2,1-2H3,(H2,18,19,21)
InChIKeyGSNOOYHPYHKOFZ-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.95
Rot. Bonds4

About 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea

1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea (PubChem CID 61348000) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea.

Molecular Properties

Compound Name1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea
PubChem CID61348000
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea
SMILESCCc1cccc(NC(=O)Nc2ccc(C(C)O)cc2)c1
InChIInChI=1S/C17H20N2O2/c1-3-13-5-4-6-16(11-13)19-17(21)18-15-9-7-14(8-10-15)12(2)20/h4-12,20H,3H2,1-2H3,(H2,18,19,21)
InChIKeyGSNOOYHPYHKOFZ-UHFFFAOYSA-N
XLogP3.95
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-chlorophenyl)-3-[4-(1-hydroxyethyl)phenyl]urea
CID 60723574
1-[3-(hydroxymethyl)phenyl]-3-(4-propan-2-ylphenyl)urea
CID 131994372
ethyl 4-[(3-ethylphenyl)carbamoylamino]benzoate
CID 46859843
1-(3-chlorophenyl)-3-(3-ethylphenyl)urea
CID 3247942
1-(3-ethylphenyl)-3-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]urea
CID 51944765
1-(3,4-dimethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea
CID 61346481
1-(3-ethylphenyl)-3-(2-hydroxy-4-methylpentyl)urea
CID 111431114
1-(4-fluorophenyl)-3-[3-(1-hydroxyethyl)phenyl]urea
CID 43508550
1-(4-ethylphenyl)-3-(4-propan-2-ylphenyl)urea
CID 4111810
4-ethyl-N-[4-[(1S)-1-hydroxyethyl]phenyl]benzamide
CID 93040826
2-(3-ethylphenoxy)-N-[(1R)-1-[4-(phenylcarbamoylamino)phenyl]ethyl]acetamide
CID 51950842
(2R)-2-[(3-ethylphenyl)carbamoylamino]-4-methylpentanoic acid
CID 78976235

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea?
The IUPAC name of 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea (CID 61348000) is 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea.
What is the SMILES notation for 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea?
The canonical SMILES for 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea is CCc1cccc(NC(=O)Nc2ccc(C(C)O)cc2)c1.
What is the InChIKey of 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea?
The InChIKey is GSNOOYHPYHKOFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-3-13-5-4-6-16(11-13)19-17(21)18-15-9-7-14(8-10-15)12(2)20/h4-12,20H,3H2,1-2H3,(H2,18,19,21).
What are the key properties of 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea?
1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea has a molecular weight of 284.36 g/mol, XLogP of 3.95, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea is sourced from PubChem (CID 61348000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).