N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide

C15H21FN2O3S — CID 34825943

IUPACN-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(F)c(C(=O)NCC2CC2)c1
InChIInChI=1S/C15H21FN2O3S/c1-3-18(4-2)22(20,21)12-7-8-14(16)13(9-12)15(19)17-10-11-5-6-11/h7-9,11H,3-6,10H2,1-2H3,(H,17,19)
InChIKeyOXIWMPXWHXZLGA-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.00
Rot. Bonds7

About N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide

N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide (PubChem CID 34825943) has the molecular formula C15H21FN2O3S and a molecular weight of 328.41 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide
PubChem CID34825943
Molecular FormulaC15H21FN2O3S
Molecular Weight328.41 g/mol
Exact Mass328.13
IUPAC NameN-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(F)c(C(=O)NCC2CC2)c1
InChIInChI=1S/C15H21FN2O3S/c1-3-18(4-2)22(20,21)12-7-8-14(16)13(9-12)15(19)17-10-11-5-6-11/h7-9,11H,3-6,10H2,1-2H3,(H,17,19)
InChIKeyOXIWMPXWHXZLGA-UHFFFAOYSA-N
XLogP2.00
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-2-fluoro-5-sulfamoylbenzamide
CID 60727294
5-(diethylsulfamoyl)-N-(2,6-difluorophenyl)-2-fluorobenzamide
CID 51158899
5-(diethylsulfamoyl)-2-fluoro-N-(2,4,6-trimethylphenyl)benzamide
CID 26085905
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide
CID 26423277
5-(diethylsulfamoyl)-2-fluoro-N-[(2R)-2-phenylpropyl]benzamide
CID 9301737
5-(diethylsulfamoyl)-2-fluoro-N-(2-morpholin-4-ylethyl)benzamide
CID 20967213
N-[2-[[5-(diethylsulfamoyl)-2-fluorobenzoyl]amino]ethyl]furan-2-carboxamide
CID 34446965
5-(diethylsulfamoyl)-2-fluoro-N-[(1-phenylcyclobutyl)methyl]benzamide
CID 46424060
5-(diethylsulfamoyl)-N-[2,6-di(propan-2-yl)phenyl]-2-fluorobenzamide
CID 26102432
N-(cyclopentylmethyl)-6-(diethylsulfamoyl)-2-oxo-1H-quinoline-4-carboxamide
CID 39211941
5-(diethylsulfamoyl)-2-fluoro-N-(2-iodophenyl)benzamide
CID 26087674
N-[5-chloro-2-(dimethylamino)phenyl]-5-(diethylsulfamoyl)-2-fluorobenzamide
CID 55336223

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide?
The IUPAC name of N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide (CID 34825943) is N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide.
What is the SMILES notation for N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide?
The canonical SMILES for N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide is CCN(CC)S(=O)(=O)c1ccc(F)c(C(=O)NCC2CC2)c1.
What is the InChIKey of N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide?
The InChIKey is OXIWMPXWHXZLGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O3S/c1-3-18(4-2)22(20,21)12-7-8-14(16)13(9-12)15(19)17-10-11-5-6-11/h7-9,11H,3-6,10H2,1-2H3,(H,17,19).
What are the key properties of N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide?
N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide has a molecular weight of 328.41 g/mol, XLogP of 2.00, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide is sourced from PubChem (CID 34825943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).