N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide

C15H21FN2O3S — CID 2985558

IUPACN-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
SMILESCCN(CC(=O)NC1CCCC1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C15H21FN2O3S/c1-2-18(11-15(19)17-13-5-3-4-6-13)22(20,21)14-9-7-12(16)8-10-14/h7-10,13H,2-6,11H2,1H3,(H,17,19)
InChIKeyPQAGRGYVDDOGIH-UHFFFAOYSA-N
MW328.41 g/mol
LogP1.90
Rot. Bonds6

About N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide

N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide (PubChem CID 2985558) has the molecular formula C15H21FN2O3S and a molecular weight of 328.41 g/mol. Its IUPAC name is N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
PubChem CID2985558
Molecular FormulaC15H21FN2O3S
Molecular Weight328.41 g/mol
Exact Mass328.13
IUPAC NameN-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
SMILESCCN(CC(=O)NC1CCCC1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C15H21FN2O3S/c1-2-18(11-15(19)17-13-5-3-4-6-13)22(20,21)14-9-7-12(16)8-10-14/h7-10,13H,2-6,11H2,1H3,(H,17,19)
InChIKeyPQAGRGYVDDOGIH-UHFFFAOYSA-N
XLogP1.90
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide?
The IUPAC name of N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide (CID 2985558) is N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide is CCN(CC(=O)NC1CCCC1)S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide?
The InChIKey is PQAGRGYVDDOGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O3S/c1-2-18(11-15(19)17-13-5-3-4-6-13)22(20,21)14-9-7-12(16)8-10-14/h7-10,13H,2-6,11H2,1H3,(H,17,19).
What are the key properties of N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide?
N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide has a molecular weight of 328.41 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide is sourced from PubChem (CID 2985558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).