2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one

C9H9ClN2O2 — CID 127013359

IUPAC2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one
SMILESO=C1CNC(c2ccc(O)c(Cl)c2)N1
InChIInChI=1S/C9H9ClN2O2/c10-6-3-5(1-2-7(6)13)9-11-4-8(14)12-9/h1-3,9,11,13H,4H2,(H,12,14)
InChIKeyJBRXNRVWFLALLA-UHFFFAOYSA-N
MW212.64 g/mol
LogP0.76
Rot. Bonds1

About 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one

2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one (PubChem CID 127013359) has the molecular formula C9H9ClN2O2 and a molecular weight of 212.64 g/mol. Its IUPAC name is 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one
PubChem CID127013359
Molecular FormulaC9H9ClN2O2
Molecular Weight212.64 g/mol
Exact Mass212.04
IUPAC Name2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one
SMILESO=C1CNC(c2ccc(O)c(Cl)c2)N1
InChIInChI=1S/C9H9ClN2O2/c10-6-3-5(1-2-7(6)13)9-11-4-8(14)12-9/h1-3,9,11,13H,4H2,(H,12,14)
InChIKeyJBRXNRVWFLALLA-UHFFFAOYSA-N
XLogP0.76
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.64
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-chloro-4-hydroxyphenyl)oxolan-2-one
CID 103439861
2-(4-bromo-2-chlorophenyl)imidazolidin-4-one
CID 131067531
2-(3-chloro-4-hydroxyphenyl)-2,3-dihydro-1H-quinolin-4-one
CID 110539671
2-chloro-4-(1,3-thiazinan-2-yl)phenol
CID 66218518
2-chloro-4-morpholin-3-ylphenol
CID 82613251
5,6-bis(4-chlorophenyl)piperazin-2-one
CID 78034573
2-(3-chloro-4-hydroxyphenyl)-5-oxooxolane-3-carboxylic acid
CID 102547393
2'-(3-chloro-4-hydroxyphenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
CID 52994313
4-(3-chloro-4-hydroxyphenyl)-3-cyclopropyl-2,4,5,7-tetrahydropyrazolo[3,4-b]pyridin-6-one
CID 169412534
(2'R,3S)-2'-(3-chloro-4-hydroxyphenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
CID 52905044
N-(3-chloro-4-hydroxyphenyl)-5-oxopyrrolidine-2-carboxamide
CID 64787520
2-(2,4-difluorophenyl)imidazolidin-4-one
CID 130678809

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one?
The IUPAC name of 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one (CID 127013359) is 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one.
What is the SMILES notation for 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one?
The canonical SMILES for 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one is O=C1CNC(c2ccc(O)c(Cl)c2)N1.
What is the InChIKey of 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one?
The InChIKey is JBRXNRVWFLALLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN2O2/c10-6-3-5(1-2-7(6)13)9-11-4-8(14)12-9/h1-3,9,11,13H,4H2,(H,12,14).
What are the key properties of 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one?
2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one has a molecular weight of 212.64 g/mol, XLogP of 0.76, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-hydroxyphenyl)imidazolidin-4-one is sourced from PubChem (CID 127013359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).