4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline

C18H21NO2 — CID 13157281

IUPAC4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline
SMILESCc1nc2ccccc2c2oc(C(C)OCC(C)C)cc12
InChIInChI=1S/C18H21NO2/c1-11(2)10-20-13(4)17-9-15-12(3)19-16-8-6-5-7-14(16)18(15)21-17/h5-9,11,13H,10H2,1-4H3
InChIKeyMVWKWMZXRCSRQC-UHFFFAOYSA-N
MW283.37 g/mol
LogP5.02
Rot. Bonds4

About 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline

4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline (PubChem CID 13157281) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline.

Molecular Properties

Compound Name4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline
PubChem CID13157281
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline
SMILESCc1nc2ccccc2c2oc(C(C)OCC(C)C)cc12
InChIInChI=1S/C18H21NO2/c1-11(2)10-20-13(4)17-9-15-12(3)19-16-8-6-5-7-14(16)18(15)21-17/h5-9,11,13H,10H2,1-4H3
InChIKeyMVWKWMZXRCSRQC-UHFFFAOYSA-N
XLogP5.02
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.37
LogP ≤ 55.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline?
The IUPAC name of 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline (CID 13157281) is 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline.
What is the SMILES notation for 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline?
The canonical SMILES for 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline is Cc1nc2ccccc2c2oc(C(C)OCC(C)C)cc12.
What is the InChIKey of 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline?
The InChIKey is MVWKWMZXRCSRQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-11(2)10-20-13(4)17-9-15-12(3)19-16-8-6-5-7-14(16)18(15)21-17/h5-9,11,13H,10H2,1-4H3.
What are the key properties of 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline?
4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline has a molecular weight of 283.37 g/mol, XLogP of 5.02, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline is sourced from PubChem (CID 13157281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).