4-chloro-1H-furo[3,4-c]quinolin-3-one

C11H6ClNO2 — CID 57030353

IUPAC4-chloro-1H-furo[3,4-c]quinolin-3-one
SMILESO=C1OCc2c1c(Cl)nc1ccccc21
InChIInChI=1S/C11H6ClNO2/c12-10-9-7(5-15-11(9)14)6-3-1-2-4-8(6)13-10/h1-4H,5H2
InChIKeyDSEYIIFJOISITJ-UHFFFAOYSA-N
MW219.63 g/mol
LogP2.56
Rot. Bonds

About 4-chloro-1H-furo[3,4-c]quinolin-3-one

4-chloro-1H-furo[3,4-c]quinolin-3-one (PubChem CID 57030353) has the molecular formula C11H6ClNO2 and a molecular weight of 219.63 g/mol. Its IUPAC name is 4-chloro-1H-furo[3,4-c]quinolin-3-one.

Molecular Properties

Compound Name4-chloro-1H-furo[3,4-c]quinolin-3-one
PubChem CID57030353
Molecular FormulaC11H6ClNO2
Molecular Weight219.63 g/mol
Exact Mass219.01
IUPAC Name4-chloro-1H-furo[3,4-c]quinolin-3-one
SMILESO=C1OCc2c1c(Cl)nc1ccccc21
InChIInChI=1S/C11H6ClNO2/c12-10-9-7(5-15-11(9)14)6-3-1-2-4-8(6)13-10/h1-4H,5H2
InChIKeyDSEYIIFJOISITJ-UHFFFAOYSA-N
XLogP2.56
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.63
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-1H-furo[3,4-c]quinolin-3-one?
The IUPAC name of 4-chloro-1H-furo[3,4-c]quinolin-3-one (CID 57030353) is 4-chloro-1H-furo[3,4-c]quinolin-3-one.
What is the SMILES notation for 4-chloro-1H-furo[3,4-c]quinolin-3-one?
The canonical SMILES for 4-chloro-1H-furo[3,4-c]quinolin-3-one is O=C1OCc2c1c(Cl)nc1ccccc21.
What is the InChIKey of 4-chloro-1H-furo[3,4-c]quinolin-3-one?
The InChIKey is DSEYIIFJOISITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClNO2/c12-10-9-7(5-15-11(9)14)6-3-1-2-4-8(6)13-10/h1-4H,5H2.
What are the key properties of 4-chloro-1H-furo[3,4-c]quinolin-3-one?
4-chloro-1H-furo[3,4-c]quinolin-3-one has a molecular weight of 219.63 g/mol, XLogP of 2.56, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1H-furo[3,4-c]quinolin-3-one is sourced from PubChem (CID 57030353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).