2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide

C13H15N3O3S — CID 56782811

IUPAC2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCOCCOc1ncccc1C(=O)N(C)c1nccs1
InChIInChI=1S/C13H15N3O3S/c1-16(13-15-6-9-20-13)12(17)10-4-3-5-14-11(10)19-8-7-18-2/h3-6,9H,7-8H2,1-2H3
InChIKeyHHEOWZQWKHTHKD-UHFFFAOYSA-N
MW293.35 g/mol
LogP1.84
Rot. Bonds6

About 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide

2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide (PubChem CID 56782811) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
PubChem CID56782811
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC Name2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCOCCOc1ncccc1C(=O)N(C)c1nccs1
InChIInChI=1S/C13H15N3O3S/c1-16(13-15-6-9-20-13)12(17)10-4-3-5-14-11(10)19-8-7-18-2/h3-6,9H,7-8H2,1-2H3
InChIKeyHHEOWZQWKHTHKD-UHFFFAOYSA-N
XLogP1.84
TPSA64.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide (CID 56782811) is 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide is COCCOc1ncccc1C(=O)N(C)c1nccs1.
What is the InChIKey of 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is HHEOWZQWKHTHKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c1-16(13-15-6-9-20-13)12(17)10-4-3-5-14-11(10)19-8-7-18-2/h3-6,9H,7-8H2,1-2H3.
What are the key properties of 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 293.35 g/mol, XLogP of 1.84, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-N-methyl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 56782811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).