8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline

C20H25NO3 — CID 13157296

IUPAC8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline
SMILESCCCCCOC(C)c1cc2c(C)nc3ccc(OC)cc3c2o1
InChIInChI=1S/C20H25NO3/c1-5-6-7-10-23-14(3)19-12-16-13(2)21-18-9-8-15(22-4)11-17(18)20(16)24-19/h8-9,11-12,14H,5-7,10H2,1-4H3
InChIKeyKQQMQNWXTZVXMA-UHFFFAOYSA-N
MW327.42 g/mol
LogP5.57
Rot. Bonds7

About 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline

8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline (PubChem CID 13157296) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline.

Molecular Properties

Compound Name8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline
PubChem CID13157296
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC Name8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline
SMILESCCCCCOC(C)c1cc2c(C)nc3ccc(OC)cc3c2o1
InChIInChI=1S/C20H25NO3/c1-5-6-7-10-23-14(3)19-12-16-13(2)21-18-9-8-15(22-4)11-17(18)20(16)24-19/h8-9,11-12,14H,5-7,10H2,1-4H3
InChIKeyKQQMQNWXTZVXMA-UHFFFAOYSA-N
XLogP5.57
TPSA44.49 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.42
LogP ≤ 55.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline?
The IUPAC name of 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline (CID 13157296) is 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline.
What is the SMILES notation for 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline?
The canonical SMILES for 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline is CCCCCOC(C)c1cc2c(C)nc3ccc(OC)cc3c2o1.
What is the InChIKey of 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline?
The InChIKey is KQQMQNWXTZVXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-5-6-7-10-23-14(3)19-12-16-13(2)21-18-9-8-15(22-4)11-17(18)20(16)24-19/h8-9,11-12,14H,5-7,10H2,1-4H3.
What are the key properties of 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline?
8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline has a molecular weight of 327.42 g/mol, XLogP of 5.57, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline is sourced from PubChem (CID 13157296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).