2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide

C17H14N2OS — CID 39922635

IUPAC2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)Nc1ccccn1
InChIInChI=1S/C17H14N2OS/c20-17(19-16-7-3-4-10-18-16)12-21-15-9-8-13-5-1-2-6-14(13)11-15/h1-11H,12H2,(H,18,19,20)
InChIKeyULWUTAMQTPKCFW-UHFFFAOYSA-N
MW294.38 g/mol
LogP3.97
Rot. Bonds4

About 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide

2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide (PubChem CID 39922635) has the molecular formula C17H14N2OS and a molecular weight of 294.38 g/mol. Its IUPAC name is 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide.

Molecular Properties

Compound Name2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide
PubChem CID39922635
Molecular FormulaC17H14N2OS
Molecular Weight294.38 g/mol
Exact Mass294.08
IUPAC Name2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)Nc1ccccn1
InChIInChI=1S/C17H14N2OS/c20-17(19-16-7-3-4-10-18-16)12-21-15-9-8-13-5-1-2-6-14(13)11-15/h1-11H,12H2,(H,18,19,20)
InChIKeyULWUTAMQTPKCFW-UHFFFAOYSA-N
XLogP3.97
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-naphthalen-2-ylsulfanyl-N-pyrimidin-2-ylacetamide
CID 2358893
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-pyridin-2-ylacetamide
CID 933898
N-pyridin-2-yl-2-pyridin-2-ylsulfanylacetamide
CID 687330
3-methoxy-N-[4-[2-oxo-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]benzamide
CID 19630369
N-[3-[2-oxo-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]butanamide
CID 18912435
N-(4-chlorophenyl)-2-naphthalen-2-ylsulfanylacetamide
CID 4560101
2-(4,6-diphenylpyrimidin-2-yl)sulfanyl-N-pyridin-2-ylacetamide
CID 40560476
2-methylsulfanyl-N-pyridin-2-ylacetamide
CID 130725350
N-[3-(carbamoylamino)phenyl]-2-naphthalen-2-ylsulfanylacetamide
CID 55539737
2-fluoro-N-[3-[2-oxo-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]benzamide
CID 18913011
2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-pyridin-2-ylacetamide
CID 154775237
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-naphthalen-2-ylsulfanylacetamide
CID 7534956

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide?
The IUPAC name of 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide (CID 39922635) is 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide.
What is the SMILES notation for 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide?
The canonical SMILES for 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide is O=C(CSc1ccc2ccccc2c1)Nc1ccccn1.
What is the InChIKey of 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide?
The InChIKey is ULWUTAMQTPKCFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2OS/c20-17(19-16-7-3-4-10-18-16)12-21-15-9-8-13-5-1-2-6-14(13)11-15/h1-11H,12H2,(H,18,19,20).
What are the key properties of 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide?
2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide has a molecular weight of 294.38 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-ylsulfanyl-N-pyridin-2-ylacetamide is sourced from PubChem (CID 39922635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).