5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide

C16H15N3O7S — CID 112522783

IUPAC5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide
SMILESO=C(Nc1cccc2[nH]c(=O)oc12)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C16H15N3O7S/c20-15(17-10-2-1-3-11-14(10)26-16(21)18-11)12-4-5-13(25-12)27(22,23)19-6-8-24-9-7-19/h1-5H,6-9H2,(H,17,20)(H,18,21)
InChIKeySCKFAJPKJRSSRT-UHFFFAOYSA-N
MW393.38 g/mol
LogP0.99
Rot. Bonds4

About 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide

5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide (PubChem CID 112522783) has the molecular formula C16H15N3O7S and a molecular weight of 393.38 g/mol. Its IUPAC name is 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide
PubChem CID112522783
Molecular FormulaC16H15N3O7S
Molecular Weight393.38 g/mol
Exact Mass393.06
IUPAC Name5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide
SMILESO=C(Nc1cccc2[nH]c(=O)oc12)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C16H15N3O7S/c20-15(17-10-2-1-3-11-14(10)26-16(21)18-11)12-4-5-13(25-12)27(22,23)19-6-8-24-9-7-19/h1-5H,6-9H2,(H,17,20)(H,18,21)
InChIKeySCKFAJPKJRSSRT-UHFFFAOYSA-N
XLogP0.99
TPSA134.85 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.38
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide?
The IUPAC name of 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide (CID 112522783) is 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide.
What is the SMILES notation for 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide?
The canonical SMILES for 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide is O=C(Nc1cccc2[nH]c(=O)oc12)c1ccc(S(=O)(=O)N2CCOCC2)o1.
What is the InChIKey of 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide?
The InChIKey is SCKFAJPKJRSSRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O7S/c20-15(17-10-2-1-3-11-14(10)26-16(21)18-11)12-4-5-13(25-12)27(22,23)19-6-8-24-9-7-19/h1-5H,6-9H2,(H,17,20)(H,18,21).
What are the key properties of 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide?
5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide has a molecular weight of 393.38 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-ylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-7-yl)furan-2-carboxamide is sourced from PubChem (CID 112522783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).