N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide

C14H20N2O3S — CID 3277460

IUPACN-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2C)cc1
InChIInChI=1S/C14H20N2O3S/c1-11-5-3-4-10-16(11)20(18,19)14-8-6-13(7-9-14)15-12(2)17/h6-9,11H,3-5,10H2,1-2H3,(H,15,17)
InChIKeyNCUSGHYMFPTESZ-UHFFFAOYSA-N
MW296.39 g/mol
LogP2.21
Rot. Bonds3

About N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide

N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide (PubChem CID 3277460) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide
PubChem CID3277460
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC NameN-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2C)cc1
InChIInChI=1S/C14H20N2O3S/c1-11-5-3-4-10-16(11)20(18,19)14-8-6-13(7-9-14)15-12(2)17/h6-9,11H,3-5,10H2,1-2H3,(H,15,17)
InChIKeyNCUSGHYMFPTESZ-UHFFFAOYSA-N
XLogP2.21
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide?
The IUPAC name of N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide (CID 3277460) is N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide.
What is the SMILES notation for N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide?
The canonical SMILES for N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2C)cc1.
What is the InChIKey of N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide?
The InChIKey is NCUSGHYMFPTESZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-11-5-3-4-10-16(11)20(18,19)14-8-6-13(7-9-14)15-12(2)17/h6-9,11H,3-5,10H2,1-2H3,(H,15,17).
What are the key properties of N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide?
N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide has a molecular weight of 296.39 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetamide is sourced from PubChem (CID 3277460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).