1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea

C15H15ClN2O2 — CID 108895874

IUPAC1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea
SMILESCc1cc(C)c(NC(=O)Nc2cccc(O)c2)c(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c1-9-6-10(2)14(13(16)7-9)18-15(20)17-11-4-3-5-12(19)8-11/h3-8,19H,1-2H3,(H2,17,18,20)
InChIKeyFHQPHZJAHIPJSC-UHFFFAOYSA-N
MW290.75 g/mol
LogP4.31
Rot. Bonds2

About 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea

1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea (PubChem CID 108895874) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea.

Molecular Properties

Compound Name1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea
PubChem CID108895874
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea
SMILESCc1cc(C)c(NC(=O)Nc2cccc(O)c2)c(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c1-9-6-10(2)14(13(16)7-9)18-15(20)17-11-4-3-5-12(19)8-11/h3-8,19H,1-2H3,(H2,17,18,20)
InChIKeyFHQPHZJAHIPJSC-UHFFFAOYSA-N
XLogP4.31
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 54.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chloro-4,6-dimethylphenyl)-3-(3-methylphenyl)urea
CID 108888004
1-(2-chloro-4,6-dimethylphenyl)-3-phenylurea
CID 731680
1-(3-acetylphenyl)-3-(2,4,6-trimethylphenyl)urea
CID 108991665
1-(2-chloro-4,6-dimethylphenyl)-3-(3,5-dimethoxyphenyl)urea
CID 108869537
1-(2-chloro-4,6-dimethylphenyl)-3-(1,3-dioxo-2-propan-2-ylisoindol-5-yl)urea
CID 108872315
1-(3-chlorophenyl)-3-[3-[(3-chlorophenyl)carbamoylamino]-2,4,6-trimethylphenyl]urea
CID 4085959
N-[4-[(3-hydroxyphenyl)carbamoylamino]phenyl]acetamide
CID 108895676
6-N-(2-chloro-4,6-dimethylphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099984
1-N-(2-chloro-4,6-dimethylphenyl)-2-N-(3-chlorophenyl)cyclopropane-1,2-dicarboxamide
CID 109142871
1-(2-chloro-6-methylphenyl)-3-(3,4-dichlorophenyl)urea
CID 4224094
ethyl 2-[(2-chloro-4,6-dimethylphenyl)carbamoylamino]benzoate
CID 108991922
N-(3-bromophenyl)-2-(2-chloro-4,6-dimethylanilino)acetamide
CID 109008766

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea?
The IUPAC name of 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea (CID 108895874) is 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea.
What is the SMILES notation for 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea?
The canonical SMILES for 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea is Cc1cc(C)c(NC(=O)Nc2cccc(O)c2)c(Cl)c1.
What is the InChIKey of 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea?
The InChIKey is FHQPHZJAHIPJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-9-6-10(2)14(13(16)7-9)18-15(20)17-11-4-3-5-12(19)8-11/h3-8,19H,1-2H3,(H2,17,18,20).
What are the key properties of 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea?
1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea has a molecular weight of 290.75 g/mol, XLogP of 4.31, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-4,6-dimethylphenyl)-3-(3-hydroxyphenyl)urea is sourced from PubChem (CID 108895874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).