6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol

C15H15NO4 — CID 86150834

IUPAC6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol
SMILESCOc1cc(O)c(OC)c2c1C(O)c1c(C)ccnc1-2
InChIInChI=1S/C15H15NO4/c1-7-4-5-16-13-10(7)14(18)11-9(19-2)6-8(17)15(20-3)12(11)13/h4-6,14,17-18H,1-3H3
InChIKeyGXHTXYSQTSSOKV-UHFFFAOYSA-N
MW273.29 g/mol
LogP2.17
Rot. Bonds2

About 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol

6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol (PubChem CID 86150834) has the molecular formula C15H15NO4 and a molecular weight of 273.29 g/mol. Its IUPAC name is 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol.

Molecular Properties

Compound Name6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol
PubChem CID86150834
Molecular FormulaC15H15NO4
Molecular Weight273.29 g/mol
Exact Mass273.10
IUPAC Name6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol
SMILESCOc1cc(O)c(OC)c2c1C(O)c1c(C)ccnc1-2
InChIInChI=1S/C15H15NO4/c1-7-4-5-16-13-10(7)14(18)11-9(19-2)6-8(17)15(20-3)12(11)13/h4-6,14,17-18H,1-3H3
InChIKeyGXHTXYSQTSSOKV-UHFFFAOYSA-N
XLogP2.17
TPSA71.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol?
The IUPAC name of 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol (CID 86150834) is 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol.
What is the SMILES notation for 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol?
The canonical SMILES for 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol is COc1cc(O)c(OC)c2c1C(O)c1c(C)ccnc1-2.
What is the InChIKey of 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol?
The InChIKey is GXHTXYSQTSSOKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4/c1-7-4-5-16-13-10(7)14(18)11-9(19-2)6-8(17)15(20-3)12(11)13/h4-6,14,17-18H,1-3H3.
What are the key properties of 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol?
6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol has a molecular weight of 273.29 g/mol, XLogP of 2.17, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,9-dimethoxy-4-methyl-5H-indeno[3,2-b]pyridine-5,8-diol is sourced from PubChem (CID 86150834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).