3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide

C15H17ClN2O4S — CID 9482091

IUPAC3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide
SMILESC[C@@H](NC(=O)CCNS(=O)(=O)c1ccc(Cl)cc1)c1ccco1
InChIInChI=1S/C15H17ClN2O4S/c1-11(14-3-2-10-22-14)18-15(19)8-9-17-23(20,21)13-6-4-12(16)5-7-13/h2-7,10-11,17H,8-9H2,1H3,(H,18,19)/t11-/m1/s1
InChIKeyORFWMWQOBYICMK-LLVKDONJSA-N
MW356.83 g/mol
LogP2.48
Rot. Bonds7

About 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide

3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide (PubChem CID 9482091) has the molecular formula C15H17ClN2O4S and a molecular weight of 356.83 g/mol. Its IUPAC name is 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide
PubChem CID9482091
Molecular FormulaC15H17ClN2O4S
Molecular Weight356.83 g/mol
Exact Mass356.06
IUPAC Name3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide
SMILESC[C@@H](NC(=O)CCNS(=O)(=O)c1ccc(Cl)cc1)c1ccco1
InChIInChI=1S/C15H17ClN2O4S/c1-11(14-3-2-10-22-14)18-15(19)8-9-17-23(20,21)13-6-4-12(16)5-7-13/h2-7,10-11,17H,8-9H2,1H3,(H,18,19)/t11-/m1/s1
InChIKeyORFWMWQOBYICMK-LLVKDONJSA-N
XLogP2.48
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.83
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(4-chlorophenyl)sulfonylamino]-N-(1-thiophen-2-ylethyl)propanamide
CID 24543595
2-[(4-fluorophenyl)sulfonylamino]-N-[1-(furan-2-yl)ethyl]acetamide
CID 166191856
3-[(4-chlorophenyl)sulfonylamino]-N-(1-pyridin-4-ylethyl)propanamide
CID 24639242
3-[(4-chlorophenyl)sulfonylamino]-N-pentan-3-ylpropanamide
CID 17225690
3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(3,4-difluorophenyl)ethyl]propanamide
CID 25493668
4-chloro-N-[(1S)-1-(furan-2-yl)ethyl]benzenesulfonamide
CID 8817386
2-[3-[(4-chlorophenyl)sulfonylamino]propanoylamino]-N-ethylpropanamide
CID 17411620
N-[1-(2-chlorophenyl)ethyl]-3-[(4-propan-2-ylphenyl)sulfonylamino]propanamide
CID 24543985
3-[(4-chlorophenyl)sulfonylamino]-N-ethylpropanamide
CID 17225661
4-[1-(furan-2-yl)ethylamino]-4-oxobutanoic acid
CID 43535656
[2-[[(1R)-1-(furan-2-yl)ethyl]amino]-2-oxoethyl] 4-(2-cyanoethylsulfamoyl)benzoate
CID 8632761
3-[(4-chlorophenyl)sulfonylamino]-N-(2-propan-2-ylphenyl)propanamide
CID 17225616

Frequently Asked Questions

What is the IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide?
The IUPAC name of 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide (CID 9482091) is 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide.
What is the SMILES notation for 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide?
The canonical SMILES for 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide is C[C@@H](NC(=O)CCNS(=O)(=O)c1ccc(Cl)cc1)c1ccco1.
What is the InChIKey of 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide?
The InChIKey is ORFWMWQOBYICMK-LLVKDONJSA-N. The full InChI is InChI=1S/C15H17ClN2O4S/c1-11(14-3-2-10-22-14)18-15(19)8-9-17-23(20,21)13-6-4-12(16)5-7-13/h2-7,10-11,17H,8-9H2,1H3,(H,18,19)/t11-/m1/s1.
What are the key properties of 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide?
3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide has a molecular weight of 356.83 g/mol, XLogP of 2.48, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(furan-2-yl)ethyl]propanamide is sourced from PubChem (CID 9482091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).