N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide

C14H14N2O2S — CID 659569

IUPACN-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide
SMILESCOc1cccc(NC(=O)CSc2ccccn2)c1
InChIInChI=1S/C14H14N2O2S/c1-18-12-6-4-5-11(9-12)16-13(17)10-19-14-7-2-3-8-15-14/h2-9H,10H2,1H3,(H,16,17)
InChIKeyMFTVFXPJYXZUGK-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.82
Rot. Bonds5

About N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide

N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide (PubChem CID 659569) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide
PubChem CID659569
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC NameN-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide
SMILESCOc1cccc(NC(=O)CSc2ccccn2)c1
InChIInChI=1S/C14H14N2O2S/c1-18-12-6-4-5-11(9-12)16-13(17)10-19-14-7-2-3-8-15-14/h2-9H,10H2,1H3,(H,16,17)
InChIKeyMFTVFXPJYXZUGK-UHFFFAOYSA-N
XLogP2.82
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxy-2-nitrophenyl)-2-pyridin-2-ylsulfanylacetamide
CID 2839113
N-[(4-methoxyphenyl)methyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide
CID 2341255
N-[2-(4-methoxyphenyl)ethyl]-2-pyridin-2-ylsulfanylacetamide
CID 2646355
3-[(4-methoxyphenyl)sulfanyl]-N-(4-pyridinylmethyl)propanamide
CID 2812946
N1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-pyridylthio)acetamide
CID 2824712
N-(3-methoxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide
CID 23093844
N-(4-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide
CID 677656
2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(3-phenoxyphenyl)acetamide
CID 2341783
2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(2-phenoxyphenyl)acetamide
CID 2342380
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide
CID 2454553
2-[Methanesulfonyl-(3-methoxy-phenyl)-amino]-N-[2-(pyridin-2-ylsulfanyl)-ethyl]-acetamide
CID 3144121
2-[N-(benzenesulfonyl)-3-methoxyanilino]-N-(2-pyridin-2-ylsulfanylethyl)acetamide
CID 3144151

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide (CID 659569) is N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide is COc1cccc(NC(=O)CSc2ccccn2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide?
The InChIKey is MFTVFXPJYXZUGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-18-12-6-4-5-11(9-12)16-13(17)10-19-14-7-2-3-8-15-14/h2-9H,10H2,1H3,(H,16,17).
What are the key properties of N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide?
N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide has a molecular weight of 274.35 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide is sourced from PubChem (CID 659569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).