2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

C17H14N2O2S — CID 35138227

IUPAC2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCc1cccs1)c1cccnc1Oc1ccccc1
InChIInChI=1S/C17H14N2O2S/c20-16(19-12-14-8-5-11-22-14)15-9-4-10-18-17(15)21-13-6-2-1-3-7-13/h1-11H,12H2,(H,19,20)
InChIKeyHQXNQOALVAIAJV-UHFFFAOYSA-N
MW310.38 g/mol
LogP3.87
Rot. Bonds5

About 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 35138227) has the molecular formula C17H14N2O2S and a molecular weight of 310.38 g/mol. Its IUPAC name is 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
PubChem CID35138227
Molecular FormulaC17H14N2O2S
Molecular Weight310.38 g/mol
Exact Mass310.08
IUPAC Name2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCc1cccs1)c1cccnc1Oc1ccccc1
InChIInChI=1S/C17H14N2O2S/c20-16(19-12-14-8-5-11-22-14)15-9-4-10-18-17(15)21-13-6-2-1-3-7-13/h1-11H,12H2,(H,19,20)
InChIKeyHQXNQOALVAIAJV-UHFFFAOYSA-N
XLogP3.87
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(thiophen-2-ylmethylcarbamoyl)pyridine-2-carboxylic acid
CID 3237026
N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide
CID 24512570
2-(ethylamino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 62165958
N-[[(2S)-oxolan-2-yl]methyl]-2-phenoxypyridine-3-carboxamide
CID 32688545
2-(2-fluoroanilino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 1441150
2-[2-(benzenesulfinyl)ethylsulfanyl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 68727895
2-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 3580913
N-(thiophen-2-ylmethyl)-2-[3-[2-(thiophen-2-ylmethylcarbamoyl)phenoxy]-2,2-bis[[2-(thiophen-2-ylmethylcarbamoyl)phenoxy]methyl]propoxy]benzamide
CID 102205335
2-(4-chloroanilino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 4998221
2-methoxy-N-[(3-phenoxyphenyl)methyl]pyridine-3-carboxamide
CID 39576822
2-phenoxy-N-[3-(2-phenylethoxy)propyl]pyridine-3-carboxamide
CID 55889564
2-(sulfanylmethyl)-N-(thiophen-2-ylmethyl)benzamide
CID 143453857

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide (CID 35138227) is 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide is O=C(NCc1cccs1)c1cccnc1Oc1ccccc1.
What is the InChIKey of 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is HQXNQOALVAIAJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2S/c20-16(19-12-14-8-5-11-22-14)15-9-4-10-18-17(15)21-13-6-2-1-3-7-13/h1-11H,12H2,(H,19,20).
What are the key properties of 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 310.38 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 35138227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).