4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol

C12H8ClN3O — CID 3582188

IUPAC4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol
SMILESOc1ccc(-c2nc3ncc(Cl)cc3[nH]2)cc1
InChIInChI=1S/C12H8ClN3O/c13-8-5-10-12(14-6-8)16-11(15-10)7-1-3-9(17)4-2-7/h1-6,17H,(H,14,15,16)
InChIKeyHYTNISQDTUBKBK-UHFFFAOYSA-N
MW245.67 g/mol
LogP2.98
Rot. Bonds1

About 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol

4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol (PubChem CID 3582188) has the molecular formula C12H8ClN3O and a molecular weight of 245.67 g/mol. Its IUPAC name is 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol.

Molecular Properties

Compound Name4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol
PubChem CID3582188
Molecular FormulaC12H8ClN3O
Molecular Weight245.67 g/mol
Exact Mass245.04
IUPAC Name4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol
SMILESOc1ccc(-c2nc3ncc(Cl)cc3[nH]2)cc1
InChIInChI=1S/C12H8ClN3O/c13-8-5-10-12(14-6-8)16-11(15-10)7-1-3-9(17)4-2-7/h1-6,17H,(H,14,15,16)
InChIKeyHYTNISQDTUBKBK-UHFFFAOYSA-N
XLogP2.98
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.67
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Sb-202190
CID 5169
RP107
CID 448912
4-(5-(4-chlorophenyl)-4-(pyridin-3-yl)-1H-imidazol-2-yl)phenol
CID 388623
L-779,450
CID 9950176
4-{5H-pyrrolo[2,3-b]pyrazin-6-yl}phenol
CID 135433406
6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 28
CID 135434952
3-chloro-4-(4H-3,4,7-triazadibenzo[cd,f]azulen-6-yl)phenol
CID 135566507
4-{2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl}phenol
CID 15897928
6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 31
CID 6538791
3-{5H-pyrrolo[2,3-b]pyrazin-6-yl}phenol
CID 6538769
6-(4-methoxyphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 6538770
7-(3-chloropropyl)-6-(4-methoxyphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 6538785

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol?
The IUPAC name of 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol (CID 3582188) is 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol.
What is the SMILES notation for 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol?
The canonical SMILES for 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol is Oc1ccc(-c2nc3ncc(Cl)cc3[nH]2)cc1.
What is the InChIKey of 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol?
The InChIKey is HYTNISQDTUBKBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN3O/c13-8-5-10-12(14-6-8)16-11(15-10)7-1-3-9(17)4-2-7/h1-6,17H,(H,14,15,16).
What are the key properties of 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol?
4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol has a molecular weight of 245.67 g/mol, XLogP of 2.98, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)phenol is sourced from PubChem (CID 3582188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).