3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide

C19H20FN3O3S — CID 18107802

IUPAC3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
SMILESO=C(CCNS(=O)(=O)c1ccc(F)cc1)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C19H20FN3O3S/c20-15-5-7-16(8-6-15)27(25,26)23-12-10-19(24)21-11-9-14-13-22-18-4-2-1-3-17(14)18/h1-8,13,22-23H,9-12H2,(H,21,24)
InChIKeyRASXXHOERKPASE-UHFFFAOYSA-N
MW389.45 g/mol
LogP2.33
Rot. Bonds8

About 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide

3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide (PubChem CID 18107802) has the molecular formula C19H20FN3O3S and a molecular weight of 389.45 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
PubChem CID18107802
Molecular FormulaC19H20FN3O3S
Molecular Weight389.45 g/mol
Exact Mass389.12
IUPAC Name3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
SMILESO=C(CCNS(=O)(=O)c1ccc(F)cc1)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C19H20FN3O3S/c20-15-5-7-16(8-6-15)27(25,26)23-12-10-19(24)21-11-9-14-13-22-18-4-2-1-3-17(14)18/h1-8,13,22-23H,9-12H2,(H,21,24)
InChIKeyRASXXHOERKPASE-UHFFFAOYSA-N
XLogP2.33
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 52.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(benzenesulfonamido)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 27644763
4-[(4-fluorophenyl)sulfonyl-methylamino]-N-[2-(1H-indol-3-yl)ethyl]butanamide
CID 27645506
3-[(4-fluorophenyl)methylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 109021183
4-(1H-indol-3-yl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]butanamide
CID 33338058
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
3-[(2,4-dimethylphenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 51164021
3-(4-fluorophenyl)sulfanyl-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 30284044
4-[2-(1H-indol-3-yl)ethylamino]-4-oxobutanoate
CID 7019224
3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 55570240
3-chloro-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 588711
3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 2108565
(2S)-2-[3-(4-fluorophenyl)sulfonylpropanoylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 42571227

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The IUPAC name of 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide (CID 18107802) is 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide.
What is the SMILES notation for 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The canonical SMILES for 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide is O=C(CCNS(=O)(=O)c1ccc(F)cc1)NCCc1c[nH]c2ccccc12.
What is the InChIKey of 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The InChIKey is RASXXHOERKPASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O3S/c20-15-5-7-16(8-6-15)27(25,26)23-12-10-19(24)21-11-9-14-13-22-18-4-2-1-3-17(14)18/h1-8,13,22-23H,9-12H2,(H,21,24).
What are the key properties of 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide?
3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide has a molecular weight of 389.45 g/mol, XLogP of 2.33, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide is sourced from PubChem (CID 18107802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).