5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol

C9H9ClN2O — CID 137272912

IUPAC5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol
SMILESOc1cc(Cl)ccc1C1=NCCN1
InChIInChI=1S/C9H9ClN2O/c10-6-1-2-7(8(13)5-6)9-11-3-4-12-9/h1-2,5,13H,3-4H2,(H,11,12)
InChIKeyOCLOXMDGXJONNM-UHFFFAOYSA-N
MW196.64 g/mol
LogP1.40
Rot. Bonds1

About 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol

5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol (PubChem CID 137272912) has the molecular formula C9H9ClN2O and a molecular weight of 196.64 g/mol. Its IUPAC name is 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol.

Molecular Properties

Compound Name5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol
PubChem CID137272912
Molecular FormulaC9H9ClN2O
Molecular Weight196.64 g/mol
Exact Mass196.04
IUPAC Name5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol
SMILESOc1cc(Cl)ccc1C1=NCCN1
InChIInChI=1S/C9H9ClN2O/c10-6-1-2-7(8(13)5-6)9-11-3-4-12-9/h1-2,5,13H,3-4H2,(H,11,12)
InChIKeyOCLOXMDGXJONNM-UHFFFAOYSA-N
XLogP1.40
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.64
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4,5-dihydro-1H-imidazol-2-yl)benzene-1,3-diol
CID 4583261
2-[5-chloro-2-[(4-chlorophenyl)methylsulfanyl]phenyl]-4,5-dihydro-1H-imidazole
CID 54304979
5-methyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)phenol
CID 137209925
3-(4,5-dihydro-1H-imidazol-2-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;hydrochloride
CID 135546480
2-[5-chloro-2-(2-methylprop-2-enylsulfanyl)phenyl]-4,5-dihydro-1H-imidazole;hydrochloride
CID 23320410
2-[2-[2-(5-chloro-2-fluorophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
CID 59715415
2-(4,5-dihydro-1H-imidazol-2-yl)-4,5-dihydro-1H-imidazole;hydrochloride
CID 54602799
2-(2-fluoro-5-methylphenyl)-4,5-dihydro-1H-imidazole;hydrochloride
CID 171378845
2-(2,3-dichlorophenyl)-4,5-dihydro-1H-imidazole
CID 110540705
5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzoxazole
CID 119091936
2-chloro-6-(4,5-dihydro-1H-imidazol-2-yl)-10,10-dioxothioxanthen-9-one
CID 10831484
2-bromo-4-(4,5-dihydro-1H-imidazol-2-yl)phenol
CID 136822392

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol?
The IUPAC name of 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol (CID 137272912) is 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol.
What is the SMILES notation for 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol?
The canonical SMILES for 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol is Oc1cc(Cl)ccc1C1=NCCN1.
What is the InChIKey of 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol?
The InChIKey is OCLOXMDGXJONNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN2O/c10-6-1-2-7(8(13)5-6)9-11-3-4-12-9/h1-2,5,13H,3-4H2,(H,11,12).
What are the key properties of 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol?
5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol has a molecular weight of 196.64 g/mol, XLogP of 1.40, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(4,5-dihydro-1H-imidazol-2-yl)phenol is sourced from PubChem (CID 137272912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).