1-fluoro-N-methylpropane-1-sulfonamide

C4H10FNO2S — CID 90730022

IUPAC1-fluoro-N-methylpropane-1-sulfonamide
SMILESCCC(F)S(=O)(=O)NC
InChIInChI=1S/C4H10FNO2S/c1-3-4(5)9(7,8)6-2/h4,6H,3H2,1-2H3
InChIKeyMZQGTMCPVOMSKB-UHFFFAOYSA-N
MW155.19 g/mol
LogP0.24
Rot. Bonds3

About 1-fluoro-N-methylpropane-1-sulfonamide

1-fluoro-N-methylpropane-1-sulfonamide (PubChem CID 90730022) has the molecular formula C4H10FNO2S and a molecular weight of 155.19 g/mol. Its IUPAC name is 1-fluoro-N-methylpropane-1-sulfonamide.

Molecular Properties

Compound Name1-fluoro-N-methylpropane-1-sulfonamide
PubChem CID90730022
Molecular FormulaC4H10FNO2S
Molecular Weight155.19 g/mol
Exact Mass155.04
IUPAC Name1-fluoro-N-methylpropane-1-sulfonamide
SMILESCCC(F)S(=O)(=O)NC
InChIInChI=1S/C4H10FNO2S/c1-3-4(5)9(7,8)6-2/h4,6H,3H2,1-2H3
InChIKeyMZQGTMCPVOMSKB-UHFFFAOYSA-N
XLogP0.24
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.19
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-fluoro-N-methylpropane-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methylbutane-1-sulfonamide
CID 13343581
N-methylcyclopropanesulfonamide
CID 15334537
N-methylethane-1-sulfonamide
CID 11105495
N-Methylpropane-1-sulfonamide
CID 14399856
N-methylpropane-2-sulfonamide
CID 20487245
3,3,3-trifluoro-N-methylpropane-1-sulfonamide
CID 88571719
Fluorobutane sulfonamide
CID 87704648
N-methyl fluoroctane sulfonamide
CID 129829200
N-(2,2,2-trifluoroethyl)butane-2-sulfonamide
CID 21029736
N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 60650267
N-(3,3,3-trifluoropropyl)propane-2-sulfonamide
CID 64585926
N-(2,2,2-trifluoroethyl)propane-2-sulfonamide
CID 64592543

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-N-methylpropane-1-sulfonamide?
The IUPAC name of 1-fluoro-N-methylpropane-1-sulfonamide (CID 90730022) is 1-fluoro-N-methylpropane-1-sulfonamide.
What is the SMILES notation for 1-fluoro-N-methylpropane-1-sulfonamide?
The canonical SMILES for 1-fluoro-N-methylpropane-1-sulfonamide is CCC(F)S(=O)(=O)NC.
What is the InChIKey of 1-fluoro-N-methylpropane-1-sulfonamide?
The InChIKey is MZQGTMCPVOMSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FNO2S/c1-3-4(5)9(7,8)6-2/h4,6H,3H2,1-2H3.
What are the key properties of 1-fluoro-N-methylpropane-1-sulfonamide?
1-fluoro-N-methylpropane-1-sulfonamide has a molecular weight of 155.19 g/mol, XLogP of 0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-N-methylpropane-1-sulfonamide is sourced from PubChem (CID 90730022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).