8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline

C13H11Cl2NO2 — CID 107622850

IUPAC8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline
SMILESCOc1cc2nc3c(c(Cl)c2cc1Cl)COCC3
InChIInChI=1S/C13H11Cl2NO2/c1-17-12-5-11-7(4-9(12)14)13(15)8-6-18-3-2-10(8)16-11/h4-5H,2-3,6H2,1H3
InChIKeyOSTNTWVHZMOYLK-UHFFFAOYSA-N
MW284.14 g/mol
LogP3.62
Rot. Bonds1

About 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline

8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline (PubChem CID 107622850) has the molecular formula C13H11Cl2NO2 and a molecular weight of 284.14 g/mol. Its IUPAC name is 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline.

Molecular Properties

Compound Name8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline
PubChem CID107622850
Molecular FormulaC13H11Cl2NO2
Molecular Weight284.14 g/mol
Exact Mass283.02
IUPAC Name8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline
SMILESCOc1cc2nc3c(c(Cl)c2cc1Cl)COCC3
InChIInChI=1S/C13H11Cl2NO2/c1-17-12-5-11-7(4-9(12)14)13(15)8-6-18-3-2-10(8)16-11/h4-5H,2-3,6H2,1H3
InChIKeyOSTNTWVHZMOYLK-UHFFFAOYSA-N
XLogP3.62
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.14
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline?
The IUPAC name of 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline (CID 107622850) is 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline.
What is the SMILES notation for 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline?
The canonical SMILES for 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline is COc1cc2nc3c(c(Cl)c2cc1Cl)COCC3.
What is the InChIKey of 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline?
The InChIKey is OSTNTWVHZMOYLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2NO2/c1-17-12-5-11-7(4-9(12)14)13(15)8-6-18-3-2-10(8)16-11/h4-5H,2-3,6H2,1H3.
What are the key properties of 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline?
8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline has a molecular weight of 284.14 g/mol, XLogP of 3.62, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline is sourced from PubChem (CID 107622850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).