5-ethyl-N-propylsulfonylfuran-2-carboxamide

C10H15NO4S — CID 71874822

IUPAC5-ethyl-N-propylsulfonylfuran-2-carboxamide
SMILESCCCS(=O)(=O)NC(=O)c1ccc(CC)o1
InChIInChI=1S/C10H15NO4S/c1-3-7-16(13,14)11-10(12)9-6-5-8(4-2)15-9/h5-6H,3-4,7H2,1-2H3,(H,11,12)
InChIKeyNDCOHVOLVQLMPP-UHFFFAOYSA-N
MW245.30 g/mol
LogP1.31
Rot. Bonds5

About 5-ethyl-N-propylsulfonylfuran-2-carboxamide

5-ethyl-N-propylsulfonylfuran-2-carboxamide (PubChem CID 71874822) has the molecular formula C10H15NO4S and a molecular weight of 245.30 g/mol. Its IUPAC name is 5-ethyl-N-propylsulfonylfuran-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-propylsulfonylfuran-2-carboxamide
PubChem CID71874822
Molecular FormulaC10H15NO4S
Molecular Weight245.30 g/mol
Exact Mass245.07
IUPAC Name5-ethyl-N-propylsulfonylfuran-2-carboxamide
SMILESCCCS(=O)(=O)NC(=O)c1ccc(CC)o1
InChIInChI=1S/C10H15NO4S/c1-3-7-16(13,14)11-10(12)9-6-5-8(4-2)15-9/h5-6H,3-4,7H2,1-2H3,(H,11,12)
InChIKeyNDCOHVOLVQLMPP-UHFFFAOYSA-N
XLogP1.31
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-propylsulfonylfuran-2-carboxamide?
The IUPAC name of 5-ethyl-N-propylsulfonylfuran-2-carboxamide (CID 71874822) is 5-ethyl-N-propylsulfonylfuran-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-propylsulfonylfuran-2-carboxamide?
The canonical SMILES for 5-ethyl-N-propylsulfonylfuran-2-carboxamide is CCCS(=O)(=O)NC(=O)c1ccc(CC)o1.
What is the InChIKey of 5-ethyl-N-propylsulfonylfuran-2-carboxamide?
The InChIKey is NDCOHVOLVQLMPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO4S/c1-3-7-16(13,14)11-10(12)9-6-5-8(4-2)15-9/h5-6H,3-4,7H2,1-2H3,(H,11,12).
What are the key properties of 5-ethyl-N-propylsulfonylfuran-2-carboxamide?
5-ethyl-N-propylsulfonylfuran-2-carboxamide has a molecular weight of 245.30 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-propylsulfonylfuran-2-carboxamide is sourced from PubChem (CID 71874822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).