(2-chloro-5-methoxyphenyl)urea

C8H9ClN2O2 — CID 21093757

IUPAC(2-chloro-5-methoxyphenyl)urea
SMILESCOc1ccc(Cl)c(NC(N)=O)c1
InChIInChI=1S/C8H9ClN2O2/c1-13-5-2-3-6(9)7(4-5)11-8(10)12/h2-4H,1H3,(H3,10,11,12)
InChIKeyYCZRZJHEFXHMKI-UHFFFAOYSA-N
MW200.62 g/mol
LogP1.84
Rot. Bonds2

About (2-chloro-5-methoxyphenyl)urea

(2-chloro-5-methoxyphenyl)urea (PubChem CID 21093757) has the molecular formula C8H9ClN2O2 and a molecular weight of 200.62 g/mol. Its IUPAC name is (2-chloro-5-methoxyphenyl)urea.

Molecular Properties

Compound Name(2-chloro-5-methoxyphenyl)urea
PubChem CID21093757
Molecular FormulaC8H9ClN2O2
Molecular Weight200.62 g/mol
Exact Mass200.04
IUPAC Name(2-chloro-5-methoxyphenyl)urea
SMILESCOc1ccc(Cl)c(NC(N)=O)c1
InChIInChI=1S/C8H9ClN2O2/c1-13-5-2-3-6(9)7(4-5)11-8(10)12/h2-4H,1H3,(H3,10,11,12)
InChIKeyYCZRZJHEFXHMKI-UHFFFAOYSA-N
XLogP1.84
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.62
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-Chloro-m-anisidine
CID 75460
3-Ureidoanisole
CID 101483
1-(4-Chlorophenyl)-3-(4-methoxyphenyl)urea
CID 295294
1-(3-Chloro-4-methylphenyl)-3-(3-methoxyphenyl)urea
CID 727824
3-(3-Methoxyphenyl)-1,1-dimethylurea
CID 34178
1-(3-Chlorophenyl)-3-(3-methoxyphenyl)urea
CID 295289
2-chloro-N-(3-methoxyphenyl)acetamide
CID 28667
Urea, 1-(2-chloroethyl)-3-(m-anisyl)-
CID 96663
1-(4-Chlorophenyl)-3-(3-methoxyphenyl)urea
CID 730368
1-(2-Chlorophenyl)-3-(2-methoxyphenyl)urea
CID 295267
N-(2-chlorophenyl)-4-(3-methoxyphenyl)-1-piperazinecarboxamide
CID 894868
N-(2-chloro-5-methoxyphenyl)-N'-[2-(4-phenyl-1-piperazinyl)ethyl]urea
CID 1257437

Frequently Asked Questions

What is the IUPAC name of (2-chloro-5-methoxyphenyl)urea?
The IUPAC name of (2-chloro-5-methoxyphenyl)urea (CID 21093757) is (2-chloro-5-methoxyphenyl)urea.
What is the SMILES notation for (2-chloro-5-methoxyphenyl)urea?
The canonical SMILES for (2-chloro-5-methoxyphenyl)urea is COc1ccc(Cl)c(NC(N)=O)c1.
What is the InChIKey of (2-chloro-5-methoxyphenyl)urea?
The InChIKey is YCZRZJHEFXHMKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O2/c1-13-5-2-3-6(9)7(4-5)11-8(10)12/h2-4H,1H3,(H3,10,11,12).
What are the key properties of (2-chloro-5-methoxyphenyl)urea?
(2-chloro-5-methoxyphenyl)urea has a molecular weight of 200.62 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-5-methoxyphenyl)urea is sourced from PubChem (CID 21093757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).