3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide

C18H18F2N2O3S — CID 92645802

IUPAC3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide
SMILESO=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)Nc1cc(F)ccc1F
InChIInChI=1S/C18H18F2N2O3S/c19-13-4-9-16(20)17(11-13)21-18(23)10-3-12-1-7-15(8-2-12)26(24,25)22-14-5-6-14/h1-2,4,7-9,11,14,22H,3,5-6,10H2,(H,21,23)
InChIKeySVPPQHJWEBJPCM-UHFFFAOYSA-N
MW380.42 g/mol
LogP2.98
Rot. Bonds7

About 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide

3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide (PubChem CID 92645802) has the molecular formula C18H18F2N2O3S and a molecular weight of 380.42 g/mol. Its IUPAC name is 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide.

Molecular Properties

Compound Name3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide
PubChem CID92645802
Molecular FormulaC18H18F2N2O3S
Molecular Weight380.42 g/mol
Exact Mass380.10
IUPAC Name3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide
SMILESO=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)Nc1cc(F)ccc1F
InChIInChI=1S/C18H18F2N2O3S/c19-13-4-9-16(20)17(11-13)21-18(23)10-3-12-1-7-15(8-2-12)26(24,25)22-14-5-6-14/h1-2,4,7-9,11,14,22H,3,5-6,10H2,(H,21,23)
InChIKeySVPPQHJWEBJPCM-UHFFFAOYSA-N
XLogP2.98
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.42
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-chloro-2-(trifluoromethyl)phenyl]-3-[4-(cyclopropylsulfamoyl)phenyl]propanamide
CID 92645790
3-[4-(cyclohexylsulfamoyl)phenyl]-N-(4-fluorophenyl)propanamide
CID 126248632
N-(2,5-difluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 27444998
3-(4-chlorophenyl)-N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]propanamide
CID 33161073
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-[4-(cyclopropylsulfamoyl)phenyl]propanamide
CID 55577808
3-(4-cyanophenyl)-N-(2,5-difluorophenyl)propanamide
CID 41484985
3-[4-(cyclopropylsulfamoyl)phenyl]-N-[4-(ethylsulfonylamino)phenyl]propanamide
CID 55959827
N-[2-chloro-5-(trifluoromethyl)phenyl]-3-[4-(cyclohexylsulfamoyl)phenyl]propanamide
CID 1296344
N-(3-aminopropyl)-3-[4-(cyclopropylsulfamoyl)phenyl]propanamide;hydrochloride
CID 119404968
3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 31826579
N-[[4-(cyclopropylsulfamoyl)phenyl]methyl]-2,4-difluorobenzamide
CID 51120364
N-[[4-(cyclopropylsulfamoyl)phenyl]methyl]-2-(4-fluorophenyl)acetamide
CID 47058155

Frequently Asked Questions

What is the IUPAC name of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide?
The IUPAC name of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide (CID 92645802) is 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide.
What is the SMILES notation for 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide?
The canonical SMILES for 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide is O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)Nc1cc(F)ccc1F.
What is the InChIKey of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide?
The InChIKey is SVPPQHJWEBJPCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O3S/c19-13-4-9-16(20)17(11-13)21-18(23)10-3-12-1-7-15(8-2-12)26(24,25)22-14-5-6-14/h1-2,4,7-9,11,14,22H,3,5-6,10H2,(H,21,23).
What are the key properties of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide?
3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide has a molecular weight of 380.42 g/mol, XLogP of 2.98, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,5-difluorophenyl)propanamide is sourced from PubChem (CID 92645802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).