N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide

C10H13N3O4S2 — CID 106379707

IUPACN-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide
SMILESCNS(=O)(=O)c1ccc(CNCc2csc(=O)[nH]2)o1
InChIInChI=1S/C10H13N3O4S2/c1-11-19(15,16)9-3-2-8(17-9)5-12-4-7-6-18-10(14)13-7/h2-3,6,11-12H,4-5H2,1H3,(H,13,14)
InChIKeyVLEIWCQQJINVGU-UHFFFAOYSA-N
MW303.37 g/mol
LogP0.23
Rot. Bonds6

About N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide

N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide (PubChem CID 106379707) has the molecular formula C10H13N3O4S2 and a molecular weight of 303.37 g/mol. Its IUPAC name is N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide.

Molecular Properties

Compound NameN-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide
PubChem CID106379707
Molecular FormulaC10H13N3O4S2
Molecular Weight303.37 g/mol
Exact Mass303.03
IUPAC NameN-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide
SMILESCNS(=O)(=O)c1ccc(CNCc2csc(=O)[nH]2)o1
InChIInChI=1S/C10H13N3O4S2/c1-11-19(15,16)9-3-2-8(17-9)5-12-4-7-6-18-10(14)13-7/h2-3,6,11-12H,4-5H2,1H3,(H,13,14)
InChIKeyVLEIWCQQJINVGU-UHFFFAOYSA-N
XLogP0.23
TPSA104.20 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 50.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide with MolForge

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Related Compounds

2-Benzenesulfonylamino-N-furan-2-ylmethyl-propionamide
CID 2963960
N-butyl-2-(furan-2-ylmethylamino)ethanesulfonamide
CID 44602033
2-Benzenesulfonylamino-N-furan-2-ylmethyl-acetamide
CID 891629
2-[(4-Fluoro-benzenesulfonyl)-methyl-amino]-N-furan-2-ylmethyl-acetamide
CID 1085430
2-[(2-Benzenesulfonylamino-acetyl)-cyclopentyl-amino]-pentanoic acid (furan-2-ylmethyl)-amide
CID 646918
2-[(2-Benzenesulfonylamino-acetyl)-furan-2-ylmethyl-amino]-N-cyclopentyl-butyramide
CID 3206785
2-[benzenesulfonyl(furan-2-ylmethyl)amino]-N-pentan-2-ylacetamide
CID 16303401
3-[2-(Ethylsulfonylamino)ethyl]-1-[(5-methylfuran-2-yl)methyl]-1-propan-2-ylurea
CID 53602071
6-(furan-2-yl)-N-(2-methylsulfonylethyl)-2-oxo-1H-pyridine-3-carboxamide
CID 72046657
1-N-butan-2-yl-4-N-cyclopentyl-4-N-[(5-methylfuran-2-yl)methyl]benzene-1,4-disulfonamide
CID 3189842
2-[3-(4-Methoxybenzenesulfonamido)-6-methyl-2-oxo-1,2-dihydropyridin-1-YL]-N-[(5-methylfuran-2-YL)methyl]acetamide
CID 87050649
8-(Benzenesulfonyl)-1-[(5-methylfuran-2-YL)methyl]-1,4,8-triazacycloundecan-5-one
CID 110200887

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide?
The IUPAC name of N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide (CID 106379707) is N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide.
What is the SMILES notation for N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide?
The canonical SMILES for N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide is CNS(=O)(=O)c1ccc(CNCc2csc(=O)[nH]2)o1.
What is the InChIKey of N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide?
The InChIKey is VLEIWCQQJINVGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O4S2/c1-11-19(15,16)9-3-2-8(17-9)5-12-4-7-6-18-10(14)13-7/h2-3,6,11-12H,4-5H2,1H3,(H,13,14).
What are the key properties of N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide?
N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide has a molecular weight of 303.37 g/mol, XLogP of 0.23, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]methyl]furan-2-sulfonamide is sourced from PubChem (CID 106379707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).