1-methyl-5-propylimidazo[4,5-c]quinolin-4-one

C14H15N3O — CID 3077021

IUPAC1-methyl-5-propylimidazo[4,5-c]quinolin-4-one
SMILESCCCn1c(=O)c2ncn(C)c2c2ccccc21
InChIInChI=1S/C14H15N3O/c1-3-8-17-11-7-5-4-6-10(11)13-12(14(17)18)15-9-16(13)2/h4-7,9H,3,8H2,1-2H3
InChIKeyOKJLBBFBIFZBFL-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.30
Rot. Bonds2

About 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one

1-methyl-5-propylimidazo[4,5-c]quinolin-4-one (PubChem CID 3077021) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one.

Molecular Properties

Compound Name1-methyl-5-propylimidazo[4,5-c]quinolin-4-one
PubChem CID3077021
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name1-methyl-5-propylimidazo[4,5-c]quinolin-4-one
SMILESCCCn1c(=O)c2ncn(C)c2c2ccccc21
InChIInChI=1S/C14H15N3O/c1-3-8-17-11-7-5-4-6-10(11)13-12(14(17)18)15-9-16(13)2/h4-7,9H,3,8H2,1-2H3
InChIKeyOKJLBBFBIFZBFL-UHFFFAOYSA-N
XLogP2.30
TPSA39.82 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one?
The IUPAC name of 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one (CID 3077021) is 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one.
What is the SMILES notation for 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one?
The canonical SMILES for 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one is CCCn1c(=O)c2ncn(C)c2c2ccccc21.
What is the InChIKey of 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one?
The InChIKey is OKJLBBFBIFZBFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-3-8-17-11-7-5-4-6-10(11)13-12(14(17)18)15-9-16(13)2/h4-7,9H,3,8H2,1-2H3.
What are the key properties of 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one?
1-methyl-5-propylimidazo[4,5-c]quinolin-4-one has a molecular weight of 241.29 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-propylimidazo[4,5-c]quinolin-4-one is sourced from PubChem (CID 3077021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).