2-ethyl-1-methoxyimidazo[4,5-c]quinoline

C13H13N3O — CID 67506760

IUPAC2-ethyl-1-methoxyimidazo[4,5-c]quinoline
SMILESCCc1nc2cnc3ccccc3c2n1OC
InChIInChI=1S/C13H13N3O/c1-3-12-15-11-8-14-10-7-5-4-6-9(10)13(11)16(12)17-2/h4-8H,3H2,1-2H3
InChIKeySPAZQXSCSCGKJS-UHFFFAOYSA-N
MW227.27 g/mol
LogP2.21
Rot. Bonds2

About 2-ethyl-1-methoxyimidazo[4,5-c]quinoline

2-ethyl-1-methoxyimidazo[4,5-c]quinoline (PubChem CID 67506760) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is 2-ethyl-1-methoxyimidazo[4,5-c]quinoline.

Molecular Properties

Compound Name2-ethyl-1-methoxyimidazo[4,5-c]quinoline
PubChem CID67506760
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC Name2-ethyl-1-methoxyimidazo[4,5-c]quinoline
SMILESCCc1nc2cnc3ccccc3c2n1OC
InChIInChI=1S/C13H13N3O/c1-3-12-15-11-8-14-10-7-5-4-6-9(10)13(11)16(12)17-2/h4-8H,3H2,1-2H3
InChIKeySPAZQXSCSCGKJS-UHFFFAOYSA-N
XLogP2.21
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Imiquimod
CID 57469
2-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
CID 1530
2-Amino-3-methylimidazo(4,5-f)quinoline
CID 53462
2-Amino-3,4-dimethylimidazo(4,5-f)quinoline
CID 62274
2-Amino-3,4,8-trimethylimidazo(4,5-f)quinoxaline
CID 104739
2-(Hydroxyamino)-1-methyl-6-phenylimidazo(4,5-b)pyridine
CID 104954
CR-4056
CID 24898732
N-Hydroxy-3-methyl-3H-imidazo(4,5-f)quinolin-2-amine
CID 105079
1-[[4-(Aminomethyl)phenyl]methyl]-2-Butyl-Imidazo[4,5-C]quinolin-4-Amine
CID 52945312
3-Imidazol-1-yl-quinoline
CID 12354256
3-Phenylimidazo(1,5-a)pyridine
CID 606670
Sotirimod
CID 6450818

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-methoxyimidazo[4,5-c]quinoline?
The IUPAC name of 2-ethyl-1-methoxyimidazo[4,5-c]quinoline (CID 67506760) is 2-ethyl-1-methoxyimidazo[4,5-c]quinoline.
What is the SMILES notation for 2-ethyl-1-methoxyimidazo[4,5-c]quinoline?
The canonical SMILES for 2-ethyl-1-methoxyimidazo[4,5-c]quinoline is CCc1nc2cnc3ccccc3c2n1OC.
What is the InChIKey of 2-ethyl-1-methoxyimidazo[4,5-c]quinoline?
The InChIKey is SPAZQXSCSCGKJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-3-12-15-11-8-14-10-7-5-4-6-9(10)13(11)16(12)17-2/h4-8H,3H2,1-2H3.
What are the key properties of 2-ethyl-1-methoxyimidazo[4,5-c]quinoline?
2-ethyl-1-methoxyimidazo[4,5-c]quinoline has a molecular weight of 227.27 g/mol, XLogP of 2.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-methoxyimidazo[4,5-c]quinoline is sourced from PubChem (CID 67506760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).