(2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide

C23H24N2OS — CID 7037129

IUPAC(2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide
SMILESCCc1cccc(CC)c1NC(=O)[C@H](Sc1ccccn1)c1ccccc1
InChIInChI=1S/C23H24N2OS/c1-3-17-13-10-14-18(4-2)21(17)25-23(26)22(19-11-6-5-7-12-19)27-20-15-8-9-16-24-20/h5-16,22H,3-4H2,1-2H3,(H,25,26)/t22-/m1/s1
InChIKeyXJZXUHXEIWQQMA-JOCHJYFZSA-N
MW376.53 g/mol
LogP5.68
Rot. Bonds7

About (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide

(2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide (PubChem CID 7037129) has the molecular formula C23H24N2OS and a molecular weight of 376.53 g/mol. Its IUPAC name is (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide.

Molecular Properties

Compound Name(2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide
PubChem CID7037129
Molecular FormulaC23H24N2OS
Molecular Weight376.53 g/mol
Exact Mass376.16
IUPAC Name(2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide
SMILESCCc1cccc(CC)c1NC(=O)[C@H](Sc1ccccn1)c1ccccc1
InChIInChI=1S/C23H24N2OS/c1-3-17-13-10-14-18(4-2)21(17)25-23(26)22(19-11-6-5-7-12-19)27-20-15-8-9-16-24-20/h5-16,22H,3-4H2,1-2H3,(H,25,26)/t22-/m1/s1
InChIKeyXJZXUHXEIWQQMA-JOCHJYFZSA-N
XLogP5.68
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.53
LogP ≤ 55.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-[(2-phenyl-2-pyridin-2-ylsulfanylacetyl)amino]benzoate
CID 123132769
2-phenyl-2-pyridin-2-ylsulfanylacetic acid
CID 18073234
N-(2,6-diethylphenyl)pyridine-2-carboxamide
CID 19224278
N-(2,6-dimethylphenyl)-2-pyridin-2-ylsulfanylpropanamide
CID 51234191
2-phenyl-2-phenylsulfanyl-N-pyrimidin-2-ylacetamide
CID 5196122
(2S)-2-phenyl-2-phenylsulfanyl-N-pyridin-2-ylacetamide
CID 40546464
N-(3,5-dichlorophenyl)-2-(4-methoxyphenyl)-2-pyridin-2-ylsulfanylacetamide
CID 123457493
N-(1-phenylbutyl)-2-pyridin-2-ylsulfanylpropanamide
CID 46810322
3-phenyl-3-(2-pyridin-2-ylsulfanylpropanoylamino)propanoic acid
CID 53215548
2-(1-phenylbutylsulfanyl)pyridine
CID 22764663
(2R)-2-pyridin-2-ylsulfanyl-N-(2,4,6-trimethylphenyl)propanamide
CID 674012
2-(benzhydrylamino)-N-(2,6-diethylphenyl)acetamide
CID 2620925

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide?
The IUPAC name of (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide (CID 7037129) is (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide.
What is the SMILES notation for (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide?
The canonical SMILES for (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide is CCc1cccc(CC)c1NC(=O)[C@H](Sc1ccccn1)c1ccccc1.
What is the InChIKey of (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide?
The InChIKey is XJZXUHXEIWQQMA-JOCHJYFZSA-N. The full InChI is InChI=1S/C23H24N2OS/c1-3-17-13-10-14-18(4-2)21(17)25-23(26)22(19-11-6-5-7-12-19)27-20-15-8-9-16-24-20/h5-16,22H,3-4H2,1-2H3,(H,25,26)/t22-/m1/s1.
What are the key properties of (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide?
(2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide has a molecular weight of 376.53 g/mol, XLogP of 5.68, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2,6-diethylphenyl)-2-phenyl-2-pyridin-2-ylsulfanylacetamide is sourced from PubChem (CID 7037129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).