1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine

C20H20N4O — CID 11427554

IUPAC1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine
SMILESCC(C)Cn1c(Oc2ccccc2)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C20H20N4O/c1-13(2)12-24-18-15-10-6-7-11-16(15)22-19(21)17(18)23-20(24)25-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H2,21,22)
InChIKeyWMNUEYPRPNCCOM-UHFFFAOYSA-N
MW332.41 g/mol
LogP4.61
Rot. Bonds4

About 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine

1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine (PubChem CID 11427554) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine
PubChem CID11427554
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC Name1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine
SMILESCC(C)Cn1c(Oc2ccccc2)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C20H20N4O/c1-13(2)12-24-18-15-10-6-7-11-16(15)22-19(21)17(18)23-20(24)25-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H2,21,22)
InChIKeyWMNUEYPRPNCCOM-UHFFFAOYSA-N
XLogP4.61
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine?
The IUPAC name of 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine (CID 11427554) is 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine is CC(C)Cn1c(Oc2ccccc2)nc2c(N)nc3ccccc3c21.
What is the InChIKey of 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine?
The InChIKey is WMNUEYPRPNCCOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O/c1-13(2)12-24-18-15-10-6-7-11-16(15)22-19(21)17(18)23-20(24)25-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H2,21,22).
What are the key properties of 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine?
1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine has a molecular weight of 332.41 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-2-phenoxyimidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 11427554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).