2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol

C16H13ClN6O2 — CID 69299704

IUPAC2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol
SMILESCCn1c(-c2nonc2N)nc2c(-c3cccc(Cl)c3)ncc(O)c21
InChIInChI=1S/C16H13ClN6O2/c1-2-23-14-10(24)7-19-11(8-4-3-5-9(17)6-8)12(14)20-16(23)13-15(18)22-25-21-13/h3-7,24H,2H2,1H3,(H2,18,22)
InChIKeySHWMYEIOFYVCGC-UHFFFAOYSA-N
MW356.77 g/mol
LogP3.11
Rot. Bonds3

About 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol

2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol (PubChem CID 69299704) has the molecular formula C16H13ClN6O2 and a molecular weight of 356.77 g/mol. Its IUPAC name is 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol.

Molecular Properties

Compound Name2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol
PubChem CID69299704
Molecular FormulaC16H13ClN6O2
Molecular Weight356.77 g/mol
Exact Mass356.08
IUPAC Name2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol
SMILESCCn1c(-c2nonc2N)nc2c(-c3cccc(Cl)c3)ncc(O)c21
InChIInChI=1S/C16H13ClN6O2/c1-2-23-14-10(24)7-19-11(8-4-3-5-9(17)6-8)12(14)20-16(23)13-15(18)22-25-21-13/h3-7,24H,2H2,1H3,(H2,18,22)
InChIKeySHWMYEIOFYVCGC-UHFFFAOYSA-N
XLogP3.11
TPSA115.88 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.77
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol?
The IUPAC name of 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol (CID 69299704) is 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol.
What is the SMILES notation for 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol?
The canonical SMILES for 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol is CCn1c(-c2nonc2N)nc2c(-c3cccc(Cl)c3)ncc(O)c21.
What is the InChIKey of 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol?
The InChIKey is SHWMYEIOFYVCGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN6O2/c1-2-23-14-10(24)7-19-11(8-4-3-5-9(17)6-8)12(14)20-16(23)13-15(18)22-25-21-13/h3-7,24H,2H2,1H3,(H2,18,22).
What are the key properties of 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol?
2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol has a molecular weight of 356.77 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-1,2,5-oxadiazol-3-yl)-4-(3-chlorophenyl)-1-ethylimidazo[4,5-c]pyridin-7-ol is sourced from PubChem (CID 69299704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).