N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide

C16H14N2O2S — CID 2306374

IUPACN-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide
SMILESO=C(CSc1cccc2cccnc12)NCc1ccco1
InChIInChI=1S/C16H14N2O2S/c19-15(18-10-13-6-3-9-20-13)11-21-14-7-1-4-12-5-2-8-17-16(12)14/h1-9H,10-11H2,(H,18,19)
InChIKeyMOWMDEYTYWLEGU-UHFFFAOYSA-N
MW298.37 g/mol
LogP3.24
Rot. Bonds5

About N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide

N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide (PubChem CID 2306374) has the molecular formula C16H14N2O2S and a molecular weight of 298.37 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide
PubChem CID2306374
Molecular FormulaC16H14N2O2S
Molecular Weight298.37 g/mol
Exact Mass298.08
IUPAC NameN-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide
SMILESO=C(CSc1cccc2cccnc12)NCc1ccco1
InChIInChI=1S/C16H14N2O2S/c19-15(18-10-13-6-3-9-20-13)11-21-14-7-1-4-12-5-2-8-17-16(12)14/h1-9H,10-11H2,(H,18,19)
InChIKeyMOWMDEYTYWLEGU-UHFFFAOYSA-N
XLogP3.24
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-quinolin-8-yloxyethyl)thiophene-2-carboxamide
CID 1811238
N-(furan-2-ylmethyl)-2-(1-propylindol-3-yl)sulfanylacetamide
CID 3240248
N-(furan-2-ylmethyl)-2-methylquinoline-4-carboxamide
CID 2430333
N-(quinolin-3-yl)furan-2-carboxamide
CID 644708
N-(furan-2-ylmethyl)-8-[[3-(furan-2-ylmethylcarbamoyl)quinolin-8-yl]disulfanyl]quinoline-3-carboxamide
CID 126599624
N-(furan-2-ylmethyl)quinoline-2-carboxamide
CID 566063
2-(3-Cyano-7-methyl-quinolin-2-ylsulfanyl)-N-furan-2-ylmethyl-acetamide
CID 651442
2-[(3-cyano-5,7-dimethyl-2-quinolinyl)thio]-N-(2-furanylmethyl)acetamide
CID 653760
N-(2-furylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 757630
N-[2-(1H-indol-3-ylsulfanyl)ethyl]furan-2-carboxamide
CID 2156387
2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 2500137
N-(furan-2-ylmethylcarbamoyl)-2-(4-methylquinolin-2-yl)sulfanylacetamide
CID 2622916

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide (CID 2306374) is N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide is O=C(CSc1cccc2cccnc12)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide?
The InChIKey is MOWMDEYTYWLEGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2S/c19-15(18-10-13-6-3-9-20-13)11-21-14-7-1-4-12-5-2-8-17-16(12)14/h1-9H,10-11H2,(H,18,19).
What are the key properties of N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide?
N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide has a molecular weight of 298.37 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-quinolin-8-ylsulfanylacetamide is sourced from PubChem (CID 2306374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).