N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide

C18H16N2O3S — CID 2801023

IUPACN-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide
SMILESCOc1ccc(Oc2ccc(NC(=O)Cc3cccs3)cn2)cc1
InChIInChI=1S/C18H16N2O3S/c1-22-14-5-7-15(8-6-14)23-18-9-4-13(12-19-18)20-17(21)11-16-3-2-10-24-16/h2-10,12H,11H2,1H3,(H,20,21)
InChIKeyLBDRIFRRNQRXOT-UHFFFAOYSA-N
MW340.40 g/mol
LogP4.13
Rot. Bonds6

About N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide

N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide (PubChem CID 2801023) has the molecular formula C18H16N2O3S and a molecular weight of 340.40 g/mol. Its IUPAC name is N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide
PubChem CID2801023
Molecular FormulaC18H16N2O3S
Molecular Weight340.40 g/mol
Exact Mass340.09
IUPAC NameN-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide
SMILESCOc1ccc(Oc2ccc(NC(=O)Cc3cccs3)cn2)cc1
InChIInChI=1S/C18H16N2O3S/c1-22-14-5-7-15(8-6-14)23-18-9-4-13(12-19-18)20-17(21)11-16-3-2-10-24-16/h2-10,12H,11H2,1H3,(H,20,21)
InChIKeyLBDRIFRRNQRXOT-UHFFFAOYSA-N
XLogP4.13
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 2814188
CID 2814188
CID 2814266
CID 2814266
CID 1441354
CID 1441354
CID 1919175
CID 1919175
CID 3191195
CID 3191195
CID 2728416
CID 2728416
CID 2466273
CID 2466273
CID 2747402
CID 2747402
CID 52941286
CID 52941286
CID 5442631
CID 5442631
CID 2486887
CID 2486887
CID 3202593
CID 3202593

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide (CID 2801023) is N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide is COc1ccc(Oc2ccc(NC(=O)Cc3cccs3)cn2)cc1.
What is the InChIKey of N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide?
The InChIKey is LBDRIFRRNQRXOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3S/c1-22-14-5-7-15(8-6-14)23-18-9-4-13(12-19-18)20-17(21)11-16-3-2-10-24-16/h2-10,12H,11H2,1H3,(H,20,21).
What are the key properties of N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide?
N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide has a molecular weight of 340.40 g/mol, XLogP of 4.13, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 2801023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).