N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide

C21H23N3O2 — CID 53174667

IUPACN-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
SMILESCc1ccc2[nH]c(=O)c(CCC(=O)N(C)CCc3ccccn3)cc2c1
InChIInChI=1S/C21H23N3O2/c1-15-6-8-19-17(13-15)14-16(21(26)23-19)7-9-20(25)24(2)12-10-18-5-3-4-11-22-18/h3-6,8,11,13-14H,7,9-10,12H2,1-2H3,(H,23,26)
InChIKeyBOTSQQGLOIXIQI-UHFFFAOYSA-N
MW349.43 g/mol
LogP2.87
Rot. Bonds6

About N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide

N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide (PubChem CID 53174667) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide.

Molecular Properties

Compound NameN-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
PubChem CID53174667
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC NameN-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
SMILESCc1ccc2[nH]c(=O)c(CCC(=O)N(C)CCc3ccccn3)cc2c1
InChIInChI=1S/C21H23N3O2/c1-15-6-8-19-17(13-15)14-16(21(26)23-19)7-9-20(25)24(2)12-10-18-5-3-4-11-22-18/h3-6,8,11,13-14H,7,9-10,12H2,1-2H3,(H,23,26)
InChIKeyBOTSQQGLOIXIQI-UHFFFAOYSA-N
XLogP2.87
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-phenylpropanamide
CID 110331251
3-(2-aminophenyl)-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 43309211
7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one
CID 56721286
N-benzyl-3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
CID 110331632
3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)propanamide
CID 110298967
3-(3-aminophenyl)-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 43309212
N-(4-ethoxyphenyl)-3-(6-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331268
3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(3-methylphenyl)propanamide
CID 110331249
N-methyl-3-(2-methylbenzimidazol-1-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 91648936
7-fluoro-3-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-1H-quinolin-2-one
CID 56723183
3-(aminomethyl)-6-methyl-1H-quinolin-2-one
CID 6487618
N-(2,5-dimethylphenyl)-3-(6-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331255

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide?
The IUPAC name of N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide (CID 53174667) is N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide.
What is the SMILES notation for N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide?
The canonical SMILES for N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide is Cc1ccc2[nH]c(=O)c(CCC(=O)N(C)CCc3ccccn3)cc2c1.
What is the InChIKey of N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide?
The InChIKey is BOTSQQGLOIXIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-15-6-8-19-17(13-15)14-16(21(26)23-19)7-9-20(25)24(2)12-10-18-5-3-4-11-22-18/h3-6,8,11,13-14H,7,9-10,12H2,1-2H3,(H,23,26).
What are the key properties of N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide?
N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide has a molecular weight of 349.43 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 53174667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).