N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide

C14H14N2O2S — CID 2486887

IUPACN-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide
SMILESCOc1ccc(NC(=O)CSc2ccccc2)cn1
InChIInChI=1S/C14H14N2O2S/c1-18-14-8-7-11(9-15-14)16-13(17)10-19-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17)
InChIKeyBFICXBMNGQZQTA-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.82
Rot. Bonds5

About N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide

N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide (PubChem CID 2486887) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide
PubChem CID2486887
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC NameN-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide
SMILESCOc1ccc(NC(=O)CSc2ccccc2)cn1
InChIInChI=1S/C14H14N2O2S/c1-18-14-8-7-11(9-15-14)16-13(17)10-19-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17)
InChIKeyBFICXBMNGQZQTA-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

2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
CID 2561820
2-(2-methoxyphenoxy)-N-(6-methoxy-3-pyridinyl)acetamide
CID 2677021
methyl 4-[(2-phenylsulfanylacetyl)amino]benzoate
CID 807677
6-methoxy-N-(2-phenylsulfanylethyl)pyridin-3-amine
CID 79213880
2-(4-bromo-2-methylphenyl)sulfanyl-N-(6-methoxy-3-pyridinyl)acetamide
CID 7478563
N-(4-fluorophenyl)-2-phenylsulfanylacetamide
CID 532041
N-(3-hydroxy-4-methoxyphenyl)-2-phenylsulfanylacetamide
CID 7974901
N-[(1S)-3-[(6-methoxy-3-pyridinyl)amino]-3-oxo-1-phenylpropyl]benzamide
CID 9210815
2-(4-methoxyphenyl)sulfanyl-N-[4-(phenylsulfanylmethyl)phenyl]acetamide
CID 28565140
2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(6-methoxy-3-pyridinyl)acetamide
CID 46583850
2-[(3-chlorophenyl)methylsulfanyl]-N-(6-methoxy-3-pyridinyl)acetamide
CID 40713437
(3Z)-3-amino-3-hydroxyimino-N-(6-methoxy-3-pyridinyl)propanamide
CID 43156078

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide (CID 2486887) is N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide is COc1ccc(NC(=O)CSc2ccccc2)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide?
The InChIKey is BFICXBMNGQZQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-18-14-8-7-11(9-15-14)16-13(17)10-19-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17).
What are the key properties of N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide?
N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide 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-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide is sourced from PubChem (CID 2486887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).