5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide

C17H20ClN3O3 — CID 74231531

IUPAC5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide
SMILESCOCCN(Cc1cccnc1)C(=O)c1c(C)c(Cl)c(C)[nH]c1=O
InChIInChI=1S/C17H20ClN3O3/c1-11-14(16(22)20-12(2)15(11)18)17(23)21(7-8-24-3)10-13-5-4-6-19-9-13/h4-6,9H,7-8,10H2,1-3H3,(H,20,22)
InChIKeyMLMHPKWVHGGTDY-UHFFFAOYSA-N
MW349.82 g/mol
LogP2.33
Rot. Bonds6

About 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide

5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide (PubChem CID 74231531) has the molecular formula C17H20ClN3O3 and a molecular weight of 349.82 g/mol. Its IUPAC name is 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide
PubChem CID74231531
Molecular FormulaC17H20ClN3O3
Molecular Weight349.82 g/mol
Exact Mass349.12
IUPAC Name5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide
SMILESCOCCN(Cc1cccnc1)C(=O)c1c(C)c(Cl)c(C)[nH]c1=O
InChIInChI=1S/C17H20ClN3O3/c1-11-14(16(22)20-12(2)15(11)18)17(23)21(7-8-24-3)10-13-5-4-6-19-9-13/h4-6,9H,7-8,10H2,1-3H3,(H,20,22)
InChIKeyMLMHPKWVHGGTDY-UHFFFAOYSA-N
XLogP2.33
TPSA75.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.82
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide with MolForge

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Related Compounds

N-(2-methoxyethyl)-4-[(3S)-piperidin-3-yl]-N-(pyridin-3-ylmethyl)benzamide
CID 97200779
(2R)-N-(2-methoxyethyl)-2-pyrazol-1-yl-N-(pyridin-3-ylmethyl)propanamide
CID 124505741
5-chloro-4,6-dimethyl-2-oxo-N-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyridine-3-carboxamide
CID 119059891
3-(5-ethyl-2,4-dimethylpyrazol-3-yl)-1-(2-methoxyethyl)-1-(pyridin-3-ylmethyl)urea
CID 72855127
N-(2-cyanoethyl)-3,5-dimethyl-N-(pyridin-3-ylmethyl)-1H-pyrazole-4-carboxamide
CID 43582269
(3R)-N-(2-methoxyethyl)-2-methyl-N-(pyridin-3-ylmethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 95896718
methyl 3-[[2-methoxyethyl(pyridin-3-ylmethyl)carbamoyl]amino]-4-methylbenzoate
CID 118781930
2-methoxyethyl 2,4-dimethyl-5-[oxolan-2-ylmethyl(pyridin-3-ylmethyl)carbamoyl]-1H-pyrrole-3-carboxylate
CID 55900285
N,1-dibenzyl-5-chloro-N-(2-methoxyethyl)-3-methylpyrazole-4-carboxamide
CID 134028333
2,4-dimethyl-6-oxo-N-(pyridin-3-ylmethyl)-1H-pyrimidine-5-carboxamide
CID 136911249
2-[[(4-chlorophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide
CID 42769539
3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[(4-ethylphenyl)methyl]-N-(pyridin-3-ylmethyl)propanamide
CID 55385230

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide (CID 74231531) is 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide is COCCN(Cc1cccnc1)C(=O)c1c(C)c(Cl)c(C)[nH]c1=O.
What is the InChIKey of 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide?
The InChIKey is MLMHPKWVHGGTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClN3O3/c1-11-14(16(22)20-12(2)15(11)18)17(23)21(7-8-24-3)10-13-5-4-6-19-9-13/h4-6,9H,7-8,10H2,1-3H3,(H,20,22).
What are the key properties of 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide?
5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide has a molecular weight of 349.82 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-methoxyethyl)-4,6-dimethyl-2-oxo-N-(pyridin-3-ylmethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 74231531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).