N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide

C19H18F2N2O4S — CID 46336037

IUPACN-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide
SMILESCCN1C(=O)Cc2cc(S(=O)(=O)CCC(=O)Nc3ccc(F)cc3F)ccc21
InChIInChI=1S/C19H18F2N2O4S/c1-2-23-17-6-4-14(9-12(17)10-19(23)25)28(26,27)8-7-18(24)22-16-5-3-13(20)11-15(16)21/h3-6,9,11H,2,7-8,10H2,1H3,(H,22,24)
InChIKeyUDBLNMNHGHJIQZ-UHFFFAOYSA-N
MW408.43 g/mol
LogP2.68
Rot. Bonds6

About N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide

N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide (PubChem CID 46336037) has the molecular formula C19H18F2N2O4S and a molecular weight of 408.43 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide
PubChem CID46336037
Molecular FormulaC19H18F2N2O4S
Molecular Weight408.43 g/mol
Exact Mass408.10
IUPAC NameN-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide
SMILESCCN1C(=O)Cc2cc(S(=O)(=O)CCC(=O)Nc3ccc(F)cc3F)ccc21
InChIInChI=1S/C19H18F2N2O4S/c1-2-23-17-6-4-14(9-12(17)10-19(23)25)28(26,27)8-7-18(24)22-16-5-3-13(20)11-15(16)21/h3-6,9,11H,2,7-8,10H2,1H3,(H,22,24)
InChIKeyUDBLNMNHGHJIQZ-UHFFFAOYSA-N
XLogP2.68
TPSA83.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.43
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-difluorophenyl)-3-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide
CID 20938219
N-(2,4-difluorophenyl)-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]propanamide
CID 22551645
N-(2,4-dimethoxyphenyl)-3-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide
CID 20938087
N-(1-ethyl-2-oxo-3H-indol-5-yl)-2,5-difluorobenzenesulfonamide
CID 20933274
4-(benzenesulfonyl)-N-(2,4-difluorophenyl)butanamide
CID 41273162
3-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonyl]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)propanamide
CID 20938140
N-(2,4-difluorophenyl)-2-(4-ethylsulfonylphenyl)acetamide
CID 41145925
N-(2-chloro-4-fluorophenyl)-3-(4-methylphenyl)sulfonylpropanamide
CID 4101953
3-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonylamino]-N-(2,4-difluorophenyl)propanamide
CID 46253964
N-(3-chlorophenyl)-3-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide
CID 20938090
N-(1-ethyl-2-oxo-3H-indol-5-yl)acetamide
CID 20933157
N-(1-ethyl-2-oxo-3H-indol-5-yl)-3-fluorobenzenesulfonamide
CID 41342440

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide?
The IUPAC name of N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide (CID 46336037) is N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide?
The canonical SMILES for N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide is CCN1C(=O)Cc2cc(S(=O)(=O)CCC(=O)Nc3ccc(F)cc3F)ccc21.
What is the InChIKey of N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide?
The InChIKey is UDBLNMNHGHJIQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F2N2O4S/c1-2-23-17-6-4-14(9-12(17)10-19(23)25)28(26,27)8-7-18(24)22-16-5-3-13(20)11-15(16)21/h3-6,9,11H,2,7-8,10H2,1H3,(H,22,24).
What are the key properties of N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide?
N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide has a molecular weight of 408.43 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-3-[(1-ethyl-2-oxo-3H-indol-5-yl)sulfonyl]propanamide is sourced from PubChem (CID 46336037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).