(2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide

C19H16N2OS — CID 40546464

IUPAC(2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide
SMILESO=C(Nc1ccccn1)[C@@H](Sc1ccccc1)c1ccccc1
InChIInChI=1S/C19H16N2OS/c22-19(21-17-13-7-8-14-20-17)18(15-9-3-1-4-10-15)23-16-11-5-2-6-12-16/h1-14,18H,(H,20,21,22)/t18-/m0/s1
InChIKeyFMHVLVMRHSOZDT-SFHVURJKSA-N
MW320.42 g/mol
LogP4.55
Rot. Bonds5

About (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide

(2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide (PubChem CID 40546464) has the molecular formula C19H16N2OS and a molecular weight of 320.42 g/mol. Its IUPAC name is (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide.

Molecular Properties

Compound Name(2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide
PubChem CID40546464
Molecular FormulaC19H16N2OS
Molecular Weight320.42 g/mol
Exact Mass320.10
IUPAC Name(2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide
SMILESO=C(Nc1ccccn1)[C@@H](Sc1ccccc1)c1ccccc1
InChIInChI=1S/C19H16N2OS/c22-19(21-17-13-7-8-14-20-17)18(15-9-3-1-4-10-15)23-16-11-5-2-6-12-16/h1-14,18H,(H,20,21,22)/t18-/m0/s1
InChIKeyFMHVLVMRHSOZDT-SFHVURJKSA-N
XLogP4.55
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-2-phenylsulfanyl-N-pyrimidin-2-ylacetamide
CID 5196122
N-[4-[2-oxo-1-phenyl-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]thiophene-2-carboxamide
CID 22781894
2-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]sulfanyl-2-phenyl-N-pyridin-2-ylacetamide
CID 23098793
(2S)-N,2-diphenyl-2-phenylsulfanylacetamide
CID 821034
N,2-diphenyl-2-phenylsulfanylacetamide
CID 2885898
2-[3-[(4-acetylphenyl)carbamothioylamino]phenyl]sulfanyl-2-phenyl-N-pyridin-2-ylacetamide
CID 19318265
(2R)-2-phenyl-2-phenylsulfanyl-N-(1-pyridin-2-yl-1,2,4-triazol-3-yl)acetamide
CID 97255085
N-(4-methylpyrimidin-2-yl)-2-phenyl-2-phenylsulfanylacetamide
CID 17381762
(2R)-N-(4,6-dimethylpyrimidin-2-yl)-2-phenyl-2-phenylsulfanylacetamide
CID 40554986
N-(2-hydroxyphenyl)-2-phenyl-2-phenylsulfanylacetamide
CID 42918814
(2S)-N-(2,3,4,5,6-pentafluorophenyl)-2-phenyl-2-phenylsulfanylacetamide
CID 2163801
N-(5,6-dimethyl-1,2,4-triazin-3-yl)-2-phenyl-2-phenylsulfanylacetamide
CID 6412172

Frequently Asked Questions

What is the IUPAC name of (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide?
The IUPAC name of (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide (CID 40546464) is (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide.
What is the SMILES notation for (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide?
The canonical SMILES for (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide is O=C(Nc1ccccn1)[C@@H](Sc1ccccc1)c1ccccc1.
What is the InChIKey of (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide?
The InChIKey is FMHVLVMRHSOZDT-SFHVURJKSA-N. The full InChI is InChI=1S/C19H16N2OS/c22-19(21-17-13-7-8-14-20-17)18(15-9-3-1-4-10-15)23-16-11-5-2-6-12-16/h1-14,18H,(H,20,21,22)/t18-/m0/s1.
What are the key properties of (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide?
(2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide has a molecular weight of 320.42 g/mol, XLogP of 4.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide is sourced from PubChem (CID 40546464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).