2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide

C24H27N3O3 — CID 26344453

IUPAC2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
SMILESCOCc1c(C(=O)NCc2ccccn2)c(=O)cc(C)n1CCCc1ccccc1
InChIInChI=1S/C24H27N3O3/c1-18-15-22(28)23(24(29)26-16-20-12-6-7-13-25-20)21(17-30-2)27(18)14-8-11-19-9-4-3-5-10-19/h3-7,9-10,12-13,15H,8,11,14,16-17H2,1-2H3,(H,26,29)
InChIKeyBNAOENXJLWUTRU-UHFFFAOYSA-N
MW405.50 g/mol
LogP3.26
Rot. Bonds9

About 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide

2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 26344453) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
PubChem CID26344453
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC Name2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
SMILESCOCc1c(C(=O)NCc2ccccn2)c(=O)cc(C)n1CCCc1ccccc1
InChIInChI=1S/C24H27N3O3/c1-18-15-22(28)23(24(29)26-16-20-12-6-7-13-25-20)21(17-30-2)27(18)14-8-11-19-9-4-3-5-10-19/h3-7,9-10,12-13,15H,8,11,14,16-17H2,1-2H3,(H,26,29)
InChIKeyBNAOENXJLWUTRU-UHFFFAOYSA-N
XLogP3.26
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42484940
N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 26337612
2-ethyl-1-[(2-methoxyphenyl)methyl]-6-methyl-4-oxo-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42433021
6-methyl-4-oxo-2-(2-phenylethyl)-N-propan-2-yl-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42472455
1-[2-(2-chlorophenyl)ethyl]-2-(methoxymethyl)-6-methyl-4-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 42539683
1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide
CID 42667450
6-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 45235668
6-methyl-2-[(2-methylphenyl)methyl]-N-(1,2-oxazol-3-ylmethyl)-4-oxo-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42407329
5-(methoxymethyl)-N-(pyridin-2-ylmethyl)furan-2-carboxamide
CID 78827581
N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 118756559
2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-(pyridin-2-ylmethyl)acetamide
CID 75489429
2-N-(3-phenylpropyl)-4-N-(pyridin-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087124

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide (CID 26344453) is 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide is COCc1c(C(=O)NCc2ccccn2)c(=O)cc(C)n1CCCc1ccccc1.
What is the InChIKey of 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is BNAOENXJLWUTRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3/c1-18-15-22(28)23(24(29)26-16-20-12-6-7-13-25-20)21(17-30-2)27(18)14-8-11-19-9-4-3-5-10-19/h3-7,9-10,12-13,15H,8,11,14,16-17H2,1-2H3,(H,26,29).
What are the key properties of 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 405.50 g/mol, XLogP of 3.26, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 26344453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).