N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide

C15H18N2O — CID 54859248

IUPACN-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide
SMILESCc1ccc2c(NC(=O)C(C)C)c(C)ccc2n1
InChIInChI=1S/C15H18N2O/c1-9(2)15(18)17-14-10(3)5-8-13-12(14)7-6-11(4)16-13/h5-9H,1-4H3,(H,17,18)
InChIKeyYCLLJJUGDJKNJN-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.45
Rot. Bonds2

About N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide

N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide (PubChem CID 54859248) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide
PubChem CID54859248
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide
SMILESCc1ccc2c(NC(=O)C(C)C)c(C)ccc2n1
InChIInChI=1S/C15H18N2O/c1-9(2)15(18)17-14-10(3)5-8-13-12(14)7-6-11(4)16-13/h5-9H,1-4H3,(H,17,18)
InChIKeyYCLLJJUGDJKNJN-UHFFFAOYSA-N
XLogP3.45
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide?
The IUPAC name of N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide (CID 54859248) is N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide.
What is the SMILES notation for N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide?
The canonical SMILES for N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide is Cc1ccc2c(NC(=O)C(C)C)c(C)ccc2n1.
What is the InChIKey of N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide?
The InChIKey is YCLLJJUGDJKNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-9(2)15(18)17-14-10(3)5-8-13-12(14)7-6-11(4)16-13/h5-9H,1-4H3,(H,17,18).
What are the key properties of N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide?
N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide has a molecular weight of 242.32 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide is sourced from PubChem (CID 54859248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).