[1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea

C10H11ClN2O2 — CID 174510603

IUPAC[1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea
SMILESNC(=O)NC1(c2ccc(O)cc2Cl)CC1
InChIInChI=1S/C10H11ClN2O2/c11-8-5-6(14)1-2-7(8)10(3-4-10)13-9(12)15/h1-2,5,14H,3-4H2,(H3,12,13,15)
InChIKeyOSMUTYMUPPEOMI-UHFFFAOYSA-N
MW226.66 g/mol
LogP1.70
Rot. Bonds2

About [1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea

[1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea (PubChem CID 174510603) has the molecular formula C10H11ClN2O2 and a molecular weight of 226.66 g/mol. Its IUPAC name is [1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea.

Molecular Properties

Compound Name[1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea
PubChem CID174510603
Molecular FormulaC10H11ClN2O2
Molecular Weight226.66 g/mol
Exact Mass226.05
IUPAC Name[1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea
SMILESNC(=O)NC1(c2ccc(O)cc2Cl)CC1
InChIInChI=1S/C10H11ClN2O2/c11-8-5-6(14)1-2-7(8)10(3-4-10)13-9(12)15/h1-2,5,14H,3-4H2,(H3,12,13,15)
InChIKeyOSMUTYMUPPEOMI-UHFFFAOYSA-N
XLogP1.70
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.66
LogP ≤ 51.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea?
The IUPAC name of [1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea (CID 174510603) is [1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea.
What is the SMILES notation for [1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea?
The canonical SMILES for [1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea is NC(=O)NC1(c2ccc(O)cc2Cl)CC1.
What is the InChIKey of [1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea?
The InChIKey is OSMUTYMUPPEOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O2/c11-8-5-6(14)1-2-7(8)10(3-4-10)13-9(12)15/h1-2,5,14H,3-4H2,(H3,12,13,15).
What are the key properties of [1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea?
[1-(2-chloro-4-hydroxyphenyl)cyclopropyl]urea has a molecular weight of 226.66 g/mol, XLogP of 1.70, 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-hydroxyphenyl)cyclopropyl]urea is sourced from PubChem (CID 174510603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).