3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one

C20H18N2O2 — CID 122537704

IUPAC3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one
SMILESCc1c(-c2cccnc2)c2cc3c(C)coc3c(C)c2n(C)c1=O
InChIInChI=1S/C20H18N2O2/c1-11-10-24-19-13(3)18-16(8-15(11)19)17(12(2)20(23)22(18)4)14-6-5-7-21-9-14/h5-10H,1-4H3
InChIKeyIRWSUHVQJLZEDE-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.27
Rot. Bonds1

About 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one

3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one (PubChem CID 122537704) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one.

Molecular Properties

Compound Name3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one
PubChem CID122537704
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one
SMILESCc1c(-c2cccnc2)c2cc3c(C)coc3c(C)c2n(C)c1=O
InChIInChI=1S/C20H18N2O2/c1-11-10-24-19-13(3)18-16(8-15(11)19)17(12(2)20(23)22(18)4)14-6-5-7-21-9-14/h5-10H,1-4H3
InChIKeyIRWSUHVQJLZEDE-UHFFFAOYSA-N
XLogP4.27
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one?
The IUPAC name of 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one (CID 122537704) is 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one.
What is the SMILES notation for 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one?
The canonical SMILES for 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one is Cc1c(-c2cccnc2)c2cc3c(C)coc3c(C)c2n(C)c1=O.
What is the InChIKey of 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one?
The InChIKey is IRWSUHVQJLZEDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-11-10-24-19-13(3)18-16(8-15(11)19)17(12(2)20(23)22(18)4)14-6-5-7-21-9-14/h5-10H,1-4H3.
What are the key properties of 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one?
3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one has a molecular weight of 318.38 g/mol, XLogP of 4.27, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6,8,9-tetramethyl-5-pyridin-3-ylfuro[3,2-g]quinolin-7-one is sourced from PubChem (CID 122537704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).