N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide

C10H13FN2O3S — CID 113093309

IUPACN-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide
SMILESCCC(=O)Nc1cc(F)ccc1NS(C)(=O)=O
InChIInChI=1S/C10H13FN2O3S/c1-3-10(14)12-9-6-7(11)4-5-8(9)13-17(2,15)16/h4-6,13H,3H2,1-2H3,(H,12,14)
InChIKeyLHACSLNFJOZAMI-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.55
Rot. Bonds4

About N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide

N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide (PubChem CID 113093309) has the molecular formula C10H13FN2O3S and a molecular weight of 260.29 g/mol. Its IUPAC name is N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide.

Molecular Properties

Compound NameN-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide
PubChem CID113093309
Molecular FormulaC10H13FN2O3S
Molecular Weight260.29 g/mol
Exact Mass260.06
IUPAC NameN-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide
SMILESCCC(=O)Nc1cc(F)ccc1NS(C)(=O)=O
InChIInChI=1S/C10H13FN2O3S/c1-3-10(14)12-9-6-7(11)4-5-8(9)13-17(2,15)16/h4-6,13H,3H2,1-2H3,(H,12,14)
InChIKeyLHACSLNFJOZAMI-UHFFFAOYSA-N
XLogP1.55
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-fluoro-2-(methanesulfonamido)phenyl]acetamide
CID 113093308
N-[5-fluoro-2-(methanesulfonamido)phenyl]-2-phenylacetamide
CID 113093344
2-ethyl-N-[5-fluoro-2-(methanesulfonamido)phenyl]butanamide
CID 113093318
N-[5-fluoro-2-(methanesulfonamido)phenyl]-2-(4-methoxyphenyl)acetamide
CID 113093347
N-(2-bromo-4-fluorophenyl)propanamide
CID 28938564
N-[5-fluoro-2-(methanesulfonamido)phenyl]cyclobutanecarboxamide
CID 113093375
tert-butyl N-[4-fluoro-2-(propanoylamino)phenyl]carbamate
CID 56783735
methyl 5-fluoro-2-(propanoylamino)benzoate
CID 60787953
N-(2-cyano-4-fluorophenyl)propanamide
CID 79952819
N-[5-fluoro-2-(methanesulfonamido)phenyl]oxolane-2-carboxamide
CID 113093316
N-(4-fluoro-2-iodophenyl)-2-methylsulfonylacetamide
CID 79766482
N-[5-[(2,5-difluorophenyl)sulfamoyl]-2-methoxyphenyl]propanamide
CID 28558028

Frequently Asked Questions

What is the IUPAC name of N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide?
The IUPAC name of N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide (CID 113093309) is N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide.
What is the SMILES notation for N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide?
The canonical SMILES for N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide is CCC(=O)Nc1cc(F)ccc1NS(C)(=O)=O.
What is the InChIKey of N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide?
The InChIKey is LHACSLNFJOZAMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O3S/c1-3-10(14)12-9-6-7(11)4-5-8(9)13-17(2,15)16/h4-6,13H,3H2,1-2H3,(H,12,14).
What are the key properties of N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide?
N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide has a molecular weight of 260.29 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-fluoro-2-(methanesulfonamido)phenyl]propanamide is sourced from PubChem (CID 113093309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).