2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine

C19H20N4O — CID 177376202

IUPAC2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine
SMILESCCCCc1nc2c(N)nc3ccccc3c2n1Cc1ccoc1
InChIInChI=1S/C19H20N4O/c1-2-3-8-16-22-17-18(23(16)11-13-9-10-24-12-13)14-6-4-5-7-15(14)21-19(17)20/h4-7,9-10,12H,2-3,8,11H2,1H3,(H2,20,21)
InChIKeySRBNHDSHIMWGMC-UHFFFAOYSA-N
MW320.40 g/mol
LogP4.15
Rot. Bonds5

About 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine

2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine (PubChem CID 177376202) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine
PubChem CID177376202
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine
SMILESCCCCc1nc2c(N)nc3ccccc3c2n1Cc1ccoc1
InChIInChI=1S/C19H20N4O/c1-2-3-8-16-22-17-18(23(16)11-13-9-10-24-12-13)14-6-4-5-7-15(14)21-19(17)20/h4-7,9-10,12H,2-3,8,11H2,1H3,(H2,20,21)
InChIKeySRBNHDSHIMWGMC-UHFFFAOYSA-N
XLogP4.15
TPSA69.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine?
The IUPAC name of 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine (CID 177376202) is 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine is CCCCc1nc2c(N)nc3ccccc3c2n1Cc1ccoc1.
What is the InChIKey of 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine?
The InChIKey is SRBNHDSHIMWGMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-2-3-8-16-22-17-18(23(16)11-13-9-10-24-12-13)14-6-4-5-7-15(14)21-19(17)20/h4-7,9-10,12H,2-3,8,11H2,1H3,(H2,20,21).
What are the key properties of 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine?
2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine has a molecular weight of 320.40 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 177376202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).