N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide

C19H20F3NO4S — CID 55682151

IUPACN-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide
SMILESCC1CC1c1ccc(CN(C2CC2)S(=O)(=O)c2ccccc2OC(F)(F)F)o1
InChIInChI=1S/C19H20F3NO4S/c1-12-10-15(12)16-9-8-14(26-16)11-23(13-6-7-13)28(24,25)18-5-3-2-4-17(18)27-19(20,21)22/h2-5,8-9,12-13,15H,6-7,10-11H2,1H3
InChIKeyODCCFIBKGFJTCI-UHFFFAOYSA-N
MW415.43 g/mol
LogP4.65
Rot. Bonds7

About N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide

N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide (PubChem CID 55682151) has the molecular formula C19H20F3NO4S and a molecular weight of 415.43 g/mol. Its IUPAC name is N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide
PubChem CID55682151
Molecular FormulaC19H20F3NO4S
Molecular Weight415.43 g/mol
Exact Mass415.11
IUPAC NameN-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide
SMILESCC1CC1c1ccc(CN(C2CC2)S(=O)(=O)c2ccccc2OC(F)(F)F)o1
InChIInChI=1S/C19H20F3NO4S/c1-12-10-15(12)16-9-8-14(26-16)11-23(13-6-7-13)28(24,25)18-5-3-2-4-17(18)27-19(20,21)22/h2-5,8-9,12-13,15H,6-7,10-11H2,1H3
InChIKeyODCCFIBKGFJTCI-UHFFFAOYSA-N
XLogP4.65
TPSA59.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.43
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide with MolForge

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Related Compounds

N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]benzenesulfonamide
CID 42960439
N-cyclopropyl-4-methoxy-3-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]benzenesulfonamide
CID 55682011
2-bromo-N-methyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]benzenesulfonamide
CID 30142898
N-piperidin-4-yl-N-propyl-2-(trifluoromethoxy)benzenesulfonamide;hydrochloride
CID 119994071
N-cyclopropyl-N-[[3-(1-methoxypropan-2-yloxy)phenyl]methyl]-2-(trifluoromethoxy)benzenesulfonamide
CID 45185107
2,5-difluoro-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]benzenesulfonamide
CID 47015124
N-cyclopentyl-N-(furan-2-ylmethyl)-2-methoxybenzenesulfonamide
CID 71889824
N-(azetidin-3-yl)-N-methyl-2-(trifluoromethoxy)benzenesulfonamide
CID 66187577
3,3,3-trifluoro-N-methyl-N-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]propanamide
CID 94001595
2-[cyclopropyl-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]amino]-N-(3-sulfamoylphenyl)acetamide
CID 55682514
2-methoxy-N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)benzenesulfonamide
CID 90554910
1-cyclopropyl-3-(3-ethylsulfonylphenyl)-1-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]urea
CID 86973127

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide?
The IUPAC name of N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide (CID 55682151) is N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide?
The canonical SMILES for N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide is CC1CC1c1ccc(CN(C2CC2)S(=O)(=O)c2ccccc2OC(F)(F)F)o1.
What is the InChIKey of N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide?
The InChIKey is ODCCFIBKGFJTCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F3NO4S/c1-12-10-15(12)16-9-8-14(26-16)11-23(13-6-7-13)28(24,25)18-5-3-2-4-17(18)27-19(20,21)22/h2-5,8-9,12-13,15H,6-7,10-11H2,1H3.
What are the key properties of N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide?
N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide has a molecular weight of 415.43 g/mol, XLogP of 4.65, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2-(trifluoromethoxy)benzenesulfonamide is sourced from PubChem (CID 55682151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).