3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide

C12H12N2O3S — CID 175254874

IUPAC3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide
SMILESCOCOc1ccsc1C(=O)Nc1cccnc1
InChIInChI=1S/C12H12N2O3S/c1-16-8-17-10-4-6-18-11(10)12(15)14-9-3-2-5-13-7-9/h2-7H,8H2,1H3,(H,14,15)
InChIKeyXVYBILMYEWXUDD-UHFFFAOYSA-N
MW264.31 g/mol
LogP2.38
Rot. Bonds5

About 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide

3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide (PubChem CID 175254874) has the molecular formula C12H12N2O3S and a molecular weight of 264.31 g/mol. Its IUPAC name is 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide
PubChem CID175254874
Molecular FormulaC12H12N2O3S
Molecular Weight264.31 g/mol
Exact Mass264.06
IUPAC Name3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide
SMILESCOCOc1ccsc1C(=O)Nc1cccnc1
InChIInChI=1S/C12H12N2O3S/c1-16-8-17-10-4-6-18-11(10)12(15)14-9-3-2-5-13-7-9/h2-7H,8H2,1H3,(H,14,15)
InChIKeyXVYBILMYEWXUDD-UHFFFAOYSA-N
XLogP2.38
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-(3-aminoprop-1-ynyl)-N-pyridin-3-ylthiophene-2-carboxamide
CID 63801072
3-methoxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 110446009
2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide
CID 23876862
4-bromo-3,5-dimethoxy-N-pyridin-3-ylbenzamide
CID 27165075
methyl 2-amino-4-methyl-5-(pyridin-3-ylcarbamoyl)thiophene-3-carboxylate
CID 167489018
1-ethyl-1-hydroxy-3-pyridin-3-ylurea
CID 130385554
2-methoxy-N-pyridin-3-ylpyridine-4-carboxamide
CID 84580431
2-[(2-methoxyacetyl)amino]-N-pyridin-3-ylbenzamide
CID 30337604
5-oxo-N-pyridin-3-yl-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 4606085
3-chloro-4-ethoxy-5-methoxy-N-pyridin-3-ylbenzamide
CID 25343284
2-bromo-N-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 141426406
2-[(2-methylpropan-2-yl)oxy]-N-pyridin-3-ylacetamide
CID 112604829

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide?
The IUPAC name of 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide (CID 175254874) is 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide.
What is the SMILES notation for 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide?
The canonical SMILES for 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide is COCOc1ccsc1C(=O)Nc1cccnc1.
What is the InChIKey of 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide?
The InChIKey is XVYBILMYEWXUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3S/c1-16-8-17-10-4-6-18-11(10)12(15)14-9-3-2-5-13-7-9/h2-7H,8H2,1H3,(H,14,15).
What are the key properties of 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide?
3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide has a molecular weight of 264.31 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethoxy)-N-pyridin-3-ylthiophene-2-carboxamide is sourced from PubChem (CID 175254874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).