1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide

C17H21N3O3 — CID 77080615

IUPAC1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide
SMILESCCn1ccc(C(=O)N(CCOC)Cc2ccccn2)cc1=O
InChIInChI=1S/C17H21N3O3/c1-3-19-9-7-14(12-16(19)21)17(22)20(10-11-23-2)13-15-6-4-5-8-18-15/h4-9,12H,3,10-11,13H2,1-2H3
InChIKeyGUQXZLASAXKVLG-UHFFFAOYSA-N
MW315.37 g/mol
LogP1.55
Rot. Bonds7

About 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide

1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide (PubChem CID 77080615) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide
PubChem CID77080615
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC Name1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide
SMILESCCn1ccc(C(=O)N(CCOC)Cc2ccccn2)cc1=O
InChIInChI=1S/C17H21N3O3/c1-3-19-9-7-14(12-16(19)21)17(22)20(10-11-23-2)13-15-6-4-5-8-18-15/h4-9,12H,3,10-11,13H2,1-2H3
InChIKeyGUQXZLASAXKVLG-UHFFFAOYSA-N
XLogP1.55
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 61242674
N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 60559259
N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide
CID 61242673
5-iodo-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)thiophene-3-carboxamide
CID 78949460
6-chloro-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 61052322
4-bromo-N-(2-methoxyethyl)-1-methyl-N-(pyridin-2-ylmethyl)pyrrole-2-carboxamide
CID 60955229
3-ethyl-N-(2-methoxyethyl)-4-oxo-N-(pyridin-2-ylmethyl)phthalazine-1-carboxamide
CID 55980142
N-(2-methoxyethyl)-4-(4-methylpyrazol-1-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 55981418
5-bromo-2-chloro-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 60528009
5-bromo-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)thiophene-2-carboxamide
CID 61074717
4-chloro-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 61052509
3-bromo-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)thiophene-2-carboxamide
CID 61244876

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide?
The IUPAC name of 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide (CID 77080615) is 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide.
What is the SMILES notation for 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide?
The canonical SMILES for 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide is CCn1ccc(C(=O)N(CCOC)Cc2ccccn2)cc1=O.
What is the InChIKey of 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide?
The InChIKey is GUQXZLASAXKVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3/c1-3-19-9-7-14(12-16(19)21)17(22)20(10-11-23-2)13-15-6-4-5-8-18-15/h4-9,12H,3,10-11,13H2,1-2H3.
What are the key properties of 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide?
1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide has a molecular weight of 315.37 g/mol, XLogP of 1.55, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(2-methoxyethyl)-2-oxo-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide is sourced from PubChem (CID 77080615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).