8-methoxy-4-methyl-1-propylquinolin-2-one

C14H17NO2 — CID 39768477

IUPAC8-methoxy-4-methyl-1-propylquinolin-2-one
SMILESCCCn1c(=O)cc(C)c2cccc(OC)c21
InChIInChI=1S/C14H17NO2/c1-4-8-15-13(16)9-10(2)11-6-5-7-12(17-3)14(11)15/h5-7,9H,4,8H2,1-3H3
InChIKeyBWBPOAMLFNABAO-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.73
Rot. Bonds3

About 8-methoxy-4-methyl-1-propylquinolin-2-one

8-methoxy-4-methyl-1-propylquinolin-2-one (PubChem CID 39768477) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is 8-methoxy-4-methyl-1-propylquinolin-2-one.

Molecular Properties

Compound Name8-methoxy-4-methyl-1-propylquinolin-2-one
PubChem CID39768477
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name8-methoxy-4-methyl-1-propylquinolin-2-one
SMILESCCCn1c(=O)cc(C)c2cccc(OC)c21
InChIInChI=1S/C14H17NO2/c1-4-8-15-13(16)9-10(2)11-6-5-7-12(17-3)14(11)15/h5-7,9H,4,8H2,1-3H3
InChIKeyBWBPOAMLFNABAO-UHFFFAOYSA-N
XLogP2.73
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-4-methyl-1-propylquinolin-2-one?
The IUPAC name of 8-methoxy-4-methyl-1-propylquinolin-2-one (CID 39768477) is 8-methoxy-4-methyl-1-propylquinolin-2-one.
What is the SMILES notation for 8-methoxy-4-methyl-1-propylquinolin-2-one?
The canonical SMILES for 8-methoxy-4-methyl-1-propylquinolin-2-one is CCCn1c(=O)cc(C)c2cccc(OC)c21.
What is the InChIKey of 8-methoxy-4-methyl-1-propylquinolin-2-one?
The InChIKey is BWBPOAMLFNABAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-4-8-15-13(16)9-10(2)11-6-5-7-12(17-3)14(11)15/h5-7,9H,4,8H2,1-3H3.
What are the key properties of 8-methoxy-4-methyl-1-propylquinolin-2-one?
8-methoxy-4-methyl-1-propylquinolin-2-one has a molecular weight of 231.30 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-4-methyl-1-propylquinolin-2-one is sourced from PubChem (CID 39768477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).