N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide

C15H19N3O6S — CID 112528608

IUPACN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
SMILESCc1noc(C)c1CNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C15H19N3O6S/c1-10-12(11(2)24-17-10)9-16-15(19)13-3-4-14(23-13)25(20,21)18-5-7-22-8-6-18/h3-4H,5-9H2,1-2H3,(H,16,19)
InChIKeyZBAKAKKMFNDJNF-UHFFFAOYSA-N
MW369.40 g/mol
LogP0.84
Rot. Bonds5

About N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide

N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide (PubChem CID 112528608) has the molecular formula C15H19N3O6S and a molecular weight of 369.40 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
PubChem CID112528608
Molecular FormulaC15H19N3O6S
Molecular Weight369.40 g/mol
Exact Mass369.10
IUPAC NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
SMILESCc1noc(C)c1CNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C15H19N3O6S/c1-10-12(11(2)24-17-10)9-16-15(19)13-3-4-14(23-13)25(20,21)18-5-7-22-8-6-18/h3-4H,5-9H2,1-2H3,(H,16,19)
InChIKeyZBAKAKKMFNDJNF-UHFFFAOYSA-N
XLogP0.84
TPSA114.88 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.40
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(5-ethylthiophen-2-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 46466417
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]acetamide
CID 24582298
N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 110476324
N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 35993608
5-morpholin-4-ylsulfonyl-N-(2,4,6-trimethylphenyl)furan-2-carboxamide
CID 39087927
5-morpholin-4-ylsulfonyl-N-[(3-phenoxyphenyl)methyl]furan-2-carboxamide
CID 39576917
5-morpholin-4-ylsulfonyl-N-(2-phenoxyethyl)furan-2-carboxamide
CID 30233770
5-morpholin-4-ylsulfonyl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]furan-2-carboxamide
CID 46470216
(3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-(4-morpholin-4-ylsulfonylphenyl)propanoate
CID 7824841
(3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-morpholin-4-ylsulfonylbenzoate
CID 2087848
N-(2-hydroxyphenyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 84578663
(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-chloro-5-morpholin-4-ylsulfonylbenzoate
CID 4012581

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide (CID 112528608) is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide.
What is the SMILES notation for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The canonical SMILES for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide is Cc1noc(C)c1CNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1.
What is the InChIKey of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The InChIKey is ZBAKAKKMFNDJNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O6S/c1-10-12(11(2)24-17-10)9-16-15(19)13-3-4-14(23-13)25(20,21)18-5-7-22-8-6-18/h3-4H,5-9H2,1-2H3,(H,16,19).
What are the key properties of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide has a molecular weight of 369.40 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide is sourced from PubChem (CID 112528608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).