N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide

C21H20N4O — CID 10860862

IUPACN-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide
SMILESCC(C)Cn1cnc2c(NC(=O)c3ccccc3)nc3ccccc3c21
InChIInChI=1S/C21H20N4O/c1-14(2)12-25-13-22-18-19(25)16-10-6-7-11-17(16)23-20(18)24-21(26)15-8-4-3-5-9-15/h3-11,13-14H,12H2,1-2H3,(H,23,24,26)
InChIKeyTZTHLAVJQIFKRJ-UHFFFAOYSA-N
MW344.42 g/mol
LogP4.49
Rot. Bonds4

About N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide

N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide (PubChem CID 10860862) has the molecular formula C21H20N4O and a molecular weight of 344.42 g/mol. Its IUPAC name is N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide.

Molecular Properties

Compound NameN-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide
PubChem CID10860862
Molecular FormulaC21H20N4O
Molecular Weight344.42 g/mol
Exact Mass344.16
IUPAC NameN-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide
SMILESCC(C)Cn1cnc2c(NC(=O)c3ccccc3)nc3ccccc3c21
InChIInChI=1S/C21H20N4O/c1-14(2)12-25-13-22-18-19(25)16-10-6-7-11-17(16)23-20(18)24-21(26)15-8-4-3-5-9-15/h3-11,13-14H,12H2,1-2H3,(H,23,24,26)
InChIKeyTZTHLAVJQIFKRJ-UHFFFAOYSA-N
XLogP4.49
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide?
The IUPAC name of N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide (CID 10860862) is N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide.
What is the SMILES notation for N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide?
The canonical SMILES for N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide is CC(C)Cn1cnc2c(NC(=O)c3ccccc3)nc3ccccc3c21.
What is the InChIKey of N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide?
The InChIKey is TZTHLAVJQIFKRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O/c1-14(2)12-25-13-22-18-19(25)16-10-6-7-11-17(16)23-20(18)24-21(26)15-8-4-3-5-9-15/h3-11,13-14H,12H2,1-2H3,(H,23,24,26).
What are the key properties of N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide?
N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide has a molecular weight of 344.42 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]benzamide is sourced from PubChem (CID 10860862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).