(2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide

C19H16ClNOS — CID 8957293

IUPAC(2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide
SMILESC[C@@H](Sc1ccc2ccccc2c1)C(=O)Nc1ccccc1Cl
InChIInChI=1S/C19H16ClNOS/c1-13(19(22)21-18-9-5-4-8-17(18)20)23-16-11-10-14-6-2-3-7-15(14)12-16/h2-13H,1H3,(H,21,22)/t13-/m1/s1
InChIKeySAFQAARDOYCDSP-CYBMUJFWSA-N
MW341.86 g/mol
LogP5.61
Rot. Bonds4

About (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide

(2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide (PubChem CID 8957293) has the molecular formula C19H16ClNOS and a molecular weight of 341.86 g/mol. Its IUPAC name is (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide.

Molecular Properties

Compound Name(2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide
PubChem CID8957293
Molecular FormulaC19H16ClNOS
Molecular Weight341.86 g/mol
Exact Mass341.06
IUPAC Name(2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide
SMILESC[C@@H](Sc1ccc2ccccc2c1)C(=O)Nc1ccccc1Cl
InChIInChI=1S/C19H16ClNOS/c1-13(19(22)21-18-9-5-4-8-17(18)20)23-16-11-10-14-6-2-3-7-15(14)12-16/h2-13H,1H3,(H,21,22)/t13-/m1/s1
InChIKeySAFQAARDOYCDSP-CYBMUJFWSA-N
XLogP5.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.86
LogP ≤ 55.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-naphthalen-2-ylsulfanyl-N-(2-nitrophenyl)propanamide
CID 7793144
(2R)-2-naphthalen-2-ylsulfanyl-N-(2,3,4-trifluorophenyl)propanamide
CID 7793139
N-[3-[1-(2,5-dichloroanilino)-1-oxopropan-2-yl]sulfanylphenyl]naphthalene-2-carboxamide
CID 18908145
(2R)-2-(4-chlorophenyl)sulfanyl-N-(2-propan-2-ylphenyl)propanamide
CID 26294213
N-(2,3-dichlorophenyl)-2-phenylsulfanylpropanamide
CID 2955781
(2S)-N-carbamoyl-2-naphthalen-2-ylsulfanylpropanamide
CID 2500778
N-(2-chlorophenyl)-2-(2,6-dimethylpyrimidin-4-yl)sulfanylpropanamide
CID 23611424
(2S)-N-(3-chloro-2-methylphenyl)-2-(4-methoxyphenyl)sulfanylpropanamide
CID 27971654
N-(2-chlorophenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanylpropanamide
CID 18905544
(2R)-N-(2,5-dichlorophenyl)-2-phenylsulfanylpropanamide
CID 2501549
(2S)-N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-ylsulfanylpropanamide
CID 7403013
(2S)-N-(3-chloro-2-methylphenyl)-2-(3,4-difluorophenyl)sulfanylpropanamide
CID 9310309

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide?
The IUPAC name of (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide (CID 8957293) is (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide.
What is the SMILES notation for (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide?
The canonical SMILES for (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide is C[C@@H](Sc1ccc2ccccc2c1)C(=O)Nc1ccccc1Cl.
What is the InChIKey of (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide?
The InChIKey is SAFQAARDOYCDSP-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H16ClNOS/c1-13(19(22)21-18-9-5-4-8-17(18)20)23-16-11-10-14-6-2-3-7-15(14)12-16/h2-13H,1H3,(H,21,22)/t13-/m1/s1.
What are the key properties of (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide?
(2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide has a molecular weight of 341.86 g/mol, XLogP of 5.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-chlorophenyl)-2-naphthalen-2-ylsulfanylpropanamide is sourced from PubChem (CID 8957293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).