N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide

C15H12N2OS2 — CID 23972923

IUPACN-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide
SMILESO=C(CSc1cccs1)Nc1cnc2ccccc2c1
InChIInChI=1S/C15H12N2OS2/c18-14(10-20-15-6-3-7-19-15)17-12-8-11-4-1-2-5-13(11)16-9-12/h1-9H,10H2,(H,17,18)
InChIKeyHNTRAEQLWKZSQZ-UHFFFAOYSA-N
MW300.41 g/mol
LogP4.03
Rot. Bonds4

About N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide

N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide (PubChem CID 23972923) has the molecular formula C15H12N2OS2 and a molecular weight of 300.41 g/mol. Its IUPAC name is N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide
PubChem CID23972923
Molecular FormulaC15H12N2OS2
Molecular Weight300.41 g/mol
Exact Mass300.04
IUPAC NameN-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide
SMILESO=C(CSc1cccs1)Nc1cnc2ccccc2c1
InChIInChI=1S/C15H12N2OS2/c18-14(10-20-15-6-3-7-19-15)17-12-8-11-4-1-2-5-13(11)16-9-12/h1-9H,10H2,(H,17,18)
InChIKeyHNTRAEQLWKZSQZ-UHFFFAOYSA-N
XLogP4.03
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(E)-N-quinolin-3-yl-3-thiophen-2-ylprop-2-enamide
CID 18146464
4-oxo-4-(quinolin-3-ylamino)butanoic acid
CID 861757
N-(4-bromophenyl)-2-thiophen-2-ylsulfanylacetamide
CID 3334524
2-(4-acetyl-2-fluorophenyl)sulfanyl-N-quinolin-3-ylacetamide
CID 29330895
1-quinolin-3-yl-3-(1,3-thiazol-2-yl)urea
CID 47149919
N-(4-ethylphenyl)-2-thiophen-2-ylsulfanylacetamide
CID 23803925
3-nitro-4-[2-oxo-2-(quinolin-3-ylamino)ethyl]sulfanylbenzamide
CID 32838680
N-quinolin-3-yl-3-thiophen-3-ylpropanamide
CID 29330989
2-[2-oxo-2-(quinolin-3-ylamino)ethoxy]acetic acid
CID 61329390
2-hydroxy-4-[(2-thiophen-2-ylsulfanylacetyl)amino]benzoic acid
CID 43358292
N-(2-methylphenyl)-2-thiophen-2-ylsulfanylacetamide
CID 30897344
2-(4-acetamidophenyl)-N-quinolin-3-ylacetamide
CID 18146526

Frequently Asked Questions

What is the IUPAC name of N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide?
The IUPAC name of N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide (CID 23972923) is N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide.
What is the SMILES notation for N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide?
The canonical SMILES for N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide is O=C(CSc1cccs1)Nc1cnc2ccccc2c1.
What is the InChIKey of N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide?
The InChIKey is HNTRAEQLWKZSQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2OS2/c18-14(10-20-15-6-3-7-19-15)17-12-8-11-4-1-2-5-13(11)16-9-12/h1-9H,10H2,(H,17,18).
What are the key properties of N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide?
N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide has a molecular weight of 300.41 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinolin-3-yl-2-thiophen-2-ylsulfanylacetamide is sourced from PubChem (CID 23972923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).