2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide

C12H15FN2O3S — CID 113346358

IUPAC2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide
SMILESCC1(CNC(=O)c2ccc(S(N)(=O)=O)cc2F)CC1
InChIInChI=1S/C12H15FN2O3S/c1-12(4-5-12)7-15-11(16)9-3-2-8(6-10(9)13)19(14,17)18/h2-3,6H,4-5,7H2,1H3,(H,15,16)(H2,14,17,18)
InChIKeyWEPVYQFNFVCRPY-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.00
Rot. Bonds4

About 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide

2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide (PubChem CID 113346358) has the molecular formula C12H15FN2O3S and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide.

Molecular Properties

Compound Name2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide
PubChem CID113346358
Molecular FormulaC12H15FN2O3S
Molecular Weight286.33 g/mol
Exact Mass286.08
IUPAC Name2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide
SMILESCC1(CNC(=O)c2ccc(S(N)(=O)=O)cc2F)CC1
InChIInChI=1S/C12H15FN2O3S/c1-12(4-5-12)7-15-11(16)9-3-2-8(6-10(9)13)19(14,17)18/h2-3,6H,4-5,7H2,1H3,(H,15,16)(H2,14,17,18)
InChIKeyWEPVYQFNFVCRPY-UHFFFAOYSA-N
XLogP1.00
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide 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

4-bromo-2-fluoro-N-[(1-methylcyclopropyl)methyl]benzamide
CID 103722151
N-[(1-methylcyclopentyl)methyl]-4-sulfamoylbenzamide
CID 63821642
2-fluoro-N-[(1-methoxycyclobutyl)methyl]-5-sulfamoylbenzamide
CID 103991189
N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide
CID 103754265
N-(2-ethoxypropyl)-2-fluoro-4-sulfamoylbenzamide
CID 115883708
5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide
CID 103739179
2,4-dibromo-N-[(1-methylcyclopropyl)methyl]benzamide
CID 103883101
4-amino-2-fluoro-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]benzamide
CID 65117447
3-amino-2,6-difluoro-N-[(1-methylcyclopropyl)methyl]benzamide
CID 114098972
2-amino-4,5-difluoro-N-[(1-methylcyclobutyl)methyl]benzamide
CID 114107072
2-fluoro-N-pent-1-yn-3-yl-4-sulfamoylbenzamide
CID 103579485
3-fluoro-4-(2-methylpropanoyl)benzenesulfonamide
CID 70968674

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide?
The IUPAC name of 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide (CID 113346358) is 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide.
What is the SMILES notation for 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide?
The canonical SMILES for 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide is CC1(CNC(=O)c2ccc(S(N)(=O)=O)cc2F)CC1.
What is the InChIKey of 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide?
The InChIKey is WEPVYQFNFVCRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O3S/c1-12(4-5-12)7-15-11(16)9-3-2-8(6-10(9)13)19(14,17)18/h2-3,6H,4-5,7H2,1H3,(H,15,16)(H2,14,17,18).
What are the key properties of 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide?
2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide has a molecular weight of 286.33 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide is sourced from PubChem (CID 113346358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).