5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide

C15H20N4O5S — CID 22515305

IUPAC5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide
SMILESCN1C(C(=O)NCCN2CCOCC2)=CC(c2ccco2)=NS1(=O)=O
InChIInChI=1S/C15H20N4O5S/c1-18-13(15(20)16-4-5-19-6-9-23-10-7-19)11-12(17-25(18,21)22)14-3-2-8-24-14/h2-3,8,11H,4-7,9-10H2,1H3,(H,16,20)
InChIKeyJEULEACBXIOKOX-UHFFFAOYSA-N
MW368.42 g/mol
LogP-0.41
Rot. Bonds5

About 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide

5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide (PubChem CID 22515305) has the molecular formula C15H20N4O5S and a molecular weight of 368.42 g/mol. Its IUPAC name is 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide
PubChem CID22515305
Molecular FormulaC15H20N4O5S
Molecular Weight368.42 g/mol
Exact Mass368.12
IUPAC Name5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide
SMILESCN1C(C(=O)NCCN2CCOCC2)=CC(c2ccco2)=NS1(=O)=O
InChIInChI=1S/C15H20N4O5S/c1-18-13(15(20)16-4-5-19-6-9-23-10-7-19)11-12(17-25(18,21)22)14-3-2-8-24-14/h2-3,8,11H,4-7,9-10H2,1H3,(H,16,20)
InChIKeyJEULEACBXIOKOX-UHFFFAOYSA-N
XLogP-0.41
TPSA104.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.42
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide (CID 22515305) is 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide is CN1C(C(=O)NCCN2CCOCC2)=CC(c2ccco2)=NS1(=O)=O.
What is the InChIKey of 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide?
The InChIKey is JEULEACBXIOKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O5S/c1-18-13(15(20)16-4-5-19-6-9-23-10-7-19)11-12(17-25(18,21)22)14-3-2-8-24-14/h2-3,8,11H,4-7,9-10H2,1H3,(H,16,20).
What are the key properties of 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide?
5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide has a molecular weight of 368.42 g/mol, XLogP of -0.41, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-2-methyl-N-(2-morpholin-4-ylethyl)-1,1-dioxo-1,2,6-thiadiazine-3-carboxamide is sourced from PubChem (CID 22515305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).