2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide

C16H15NO3S — CID 11493176

IUPAC2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide
SMILESO=C(CSc1ccc2oc3ccccc3c2c1)NCCO
InChIInChI=1S/C16H15NO3S/c18-8-7-17-16(19)10-21-11-5-6-15-13(9-11)12-3-1-2-4-14(12)20-15/h1-6,9,18H,7-8,10H2,(H,17,19)
InChIKeyDYOFKSVTHWCHFF-UHFFFAOYSA-N
MW301.37 g/mol
LogP2.79
Rot. Bonds5

About 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide

2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide (PubChem CID 11493176) has the molecular formula C16H15NO3S and a molecular weight of 301.37 g/mol. Its IUPAC name is 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide
PubChem CID11493176
Molecular FormulaC16H15NO3S
Molecular Weight301.37 g/mol
Exact Mass301.08
IUPAC Name2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide
SMILESO=C(CSc1ccc2oc3ccccc3c2c1)NCCO
InChIInChI=1S/C16H15NO3S/c18-8-7-17-16(19)10-21-11-5-6-15-13(9-11)12-3-1-2-4-14(12)20-15/h1-6,9,18H,7-8,10H2,(H,17,19)
InChIKeyDYOFKSVTHWCHFF-UHFFFAOYSA-N
XLogP2.79
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-dibenzofuran-2-ylsulfanyl-N-morpholin-4-ylacetamide
CID 11638721
2-dibenzofuran-2-ylsulfanylpropanoic acid
CID 71395413
N-dibenzofuran-2-yl-2-pyrimidin-2-ylsulfanylacetamide
CID 8512010
N-propyldibenzofuran-2-carboxamide
CID 19048225
2-[3-chloro-4-(hydroxymethyl)phenyl]sulfanyl-N-propylacetamide
CID 114234815
2-dibenzofuran-2-ylethanol
CID 567048
2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-hydroxypropyl)acetamide
CID 5128603
2-(3,4-difluorophenyl)sulfanyl-N-(5-hydroxypentyl)acetamide
CID 107319095
2-(8-fluorodibenzofuran-2-yl)sulfanylacetamide
CID 11500065
2-dibenzofuran-2-yloxy-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 9245894
N-[2-(4-chlorophenyl)sulfanylethyl]-2-naphthalen-2-ylsulfanylacetamide
CID 7630379
5-[(2-naphthalen-2-ylsulfanylacetyl)amino]pentanoic acid
CID 119235112

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide (CID 11493176) is 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide is O=C(CSc1ccc2oc3ccccc3c2c1)NCCO.
What is the InChIKey of 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide?
The InChIKey is DYOFKSVTHWCHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3S/c18-8-7-17-16(19)10-21-11-5-6-15-13(9-11)12-3-1-2-4-14(12)20-15/h1-6,9,18H,7-8,10H2,(H,17,19).
What are the key properties of 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide?
2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide has a molecular weight of 301.37 g/mol, XLogP of 2.79, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-2-ylsulfanyl-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 11493176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).