2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide

C21H18Cl2N4O2 — CID 19592842

IUPAC2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide
SMILESCc1cnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1N1CCN(C)C1=O
InChIInChI=1S/C21H18Cl2N4O2/c1-12-11-24-18-13(19(12)27-10-9-26(2)21(27)29)5-3-8-16(18)25-20(28)17-14(22)6-4-7-15(17)23/h3-8,11H,9-10H2,1-2H3,(H,25,28)
InChIKeyJFTHCQJUFFLCMP-UHFFFAOYSA-N
MW429.31 g/mol
LogP4.97
Rot. Bonds3

About 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide

2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide (PubChem CID 19592842) has the molecular formula C21H18Cl2N4O2 and a molecular weight of 429.31 g/mol. Its IUPAC name is 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide
PubChem CID19592842
Molecular FormulaC21H18Cl2N4O2
Molecular Weight429.31 g/mol
Exact Mass428.08
IUPAC Name2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide
SMILESCc1cnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1N1CCN(C)C1=O
InChIInChI=1S/C21H18Cl2N4O2/c1-12-11-24-18-13(19(12)27-10-9-26(2)21(27)29)5-3-8-16(18)25-20(28)17-14(22)6-4-7-15(17)23/h3-8,11H,9-10H2,1-2H3,(H,25,28)
InChIKeyJFTHCQJUFFLCMP-UHFFFAOYSA-N
XLogP4.97
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.31
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide?
The IUPAC name of 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide (CID 19592842) is 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide is Cc1cnc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1N1CCN(C)C1=O.
What is the InChIKey of 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide?
The InChIKey is JFTHCQJUFFLCMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18Cl2N4O2/c1-12-11-24-18-13(19(12)27-10-9-26(2)21(27)29)5-3-8-16(18)25-20(28)17-14(22)6-4-7-15(17)23/h3-8,11H,9-10H2,1-2H3,(H,25,28).
What are the key properties of 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide?
2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide has a molecular weight of 429.31 g/mol, XLogP of 4.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[3-methyl-4-(3-methyl-2-oxoimidazolidin-1-yl)quinolin-8-yl]benzamide is sourced from PubChem (CID 19592842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).