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

C15H15ClN2O2 — CID 61221273

IUPAC1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea
SMILESO=C(Nc1ccc(CCO)cc1)Nc1cccc(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c16-12-2-1-3-14(10-12)18-15(20)17-13-6-4-11(5-7-13)8-9-19/h1-7,10,19H,8-9H2,(H2,17,18,20)
InChIKeyYJGJYYIMXKEKCD-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.52
Rot. Bonds4

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

1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea (PubChem CID 61221273) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea
PubChem CID61221273
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea
SMILESO=C(Nc1ccc(CCO)cc1)Nc1cccc(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c16-12-2-1-3-14(10-12)18-15(20)17-13-6-4-11(5-7-13)8-9-19/h1-7,10,19H,8-9H2,(H2,17,18,20)
InChIKeyYJGJYYIMXKEKCD-UHFFFAOYSA-N
XLogP3.52
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-chlorophenyl)-3-[3-(hydroxymethyl)phenyl]urea
CID 60676894
1-(4-aminophenyl)-3-[3-(2-hydroxyethyl)phenyl]urea
CID 66721682
CID 168763640
CID 168763640
1-(3-chlorophenyl)-3-(3-ethylphenyl)urea
CID 3247942
4-[(3-chlorophenyl)carbamoylamino]benzenesulfonic acid
CID 108869978
1-[4-(3-chloroanilino)phenyl]-3-phenylurea
CID 112986987
1-(3-chlorophenyl)-3-(4-methoxyphenyl)urea
CID 727874
1-(3-chloro-4-fluorophenyl)-3-(3-chlorophenyl)urea
CID 742623
1-(3-chlorophenyl)-3-[4-(1-hydroxyethyl)phenyl]urea
CID 60723574
1-(3-chlorophenyl)-3-[2-(hydroxymethyl)phenyl]urea
CID 4169533
1-(4-butan-2-ylphenyl)-3-(3-chlorophenyl)urea
CID 2930662
4-[(3-chlorophenyl)carbamoylamino]-2-fluorobenzoic acid
CID 107793077

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea?
The IUPAC name of 1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea (CID 61221273) is 1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea.
What is the SMILES notation for 1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea?
The canonical SMILES for 1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea is O=C(Nc1ccc(CCO)cc1)Nc1cccc(Cl)c1.
What is the InChIKey of 1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea?
The InChIKey is YJGJYYIMXKEKCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c16-12-2-1-3-14(10-12)18-15(20)17-13-6-4-11(5-7-13)8-9-19/h1-7,10,19H,8-9H2,(H2,17,18,20).
What are the key properties of 1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea?
1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea has a molecular weight of 290.75 g/mol, XLogP of 3.52, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-[4-(2-hydroxyethyl)phenyl]urea is sourced from PubChem (CID 61221273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).