2-methyl-N-phenacylpiperidine-1-sulfonamide

C14H20N2O3S — CID 64994247

IUPAC2-methyl-N-phenacylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)NCC(=O)c1ccccc1
InChIInChI=1S/C14H20N2O3S/c1-12-7-5-6-10-16(12)20(18,19)15-11-14(17)13-8-3-2-4-9-13/h2-4,8-9,12,15H,5-7,10-11H2,1H3
InChIKeyAVZCPPRJAPWNQN-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.58
Rot. Bonds5

About 2-methyl-N-phenacylpiperidine-1-sulfonamide

2-methyl-N-phenacylpiperidine-1-sulfonamide (PubChem CID 64994247) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is 2-methyl-N-phenacylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-phenacylpiperidine-1-sulfonamide
PubChem CID64994247
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC Name2-methyl-N-phenacylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)NCC(=O)c1ccccc1
InChIInChI=1S/C14H20N2O3S/c1-12-7-5-6-10-16(12)20(18,19)15-11-14(17)13-8-3-2-4-9-13/h2-4,8-9,12,15H,5-7,10-11H2,1H3
InChIKeyAVZCPPRJAPWNQN-UHFFFAOYSA-N
XLogP1.58
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methylpiperidin-1-yl)sulfonylamino]-N-(2-phenylethyl)acetamide
CID 51099652
2-[(2-methylpiperidin-1-yl)sulfonylamino]benzoic acid
CID 43210819
(2S)-N-[(2-chlorophenyl)methyl]-2-methylpiperidine-1-sulfonamide
CID 35293436
N-[2-(2-methylpiperidin-1-yl)sulfonylethyl]benzamide
CID 18582812
(2S)-N-[2-[(S)-benzylsulfinyl]ethyl]-2-methylpiperidine-1-sulfonamide
CID 95322188
N-phenacylcyclohexanesulfonamide
CID 64993938
1-[[(2-methylpiperidin-1-yl)sulfonylamino]methyl]cyclobutane-1-carboxylic acid
CID 115445369
(2R)-N-[(4-chlorophenyl)methyl]-2-methylpiperidine-1-sulfonamide
CID 35288491
6-[(2-methylpiperidin-1-yl)sulfonylamino]pyridine-2-carboxylic acid
CID 63641694
methyl 3-[(2-methylpiperidin-1-yl)sulfonylamino]benzoate
CID 43624206
N-(1-benzylpiperidin-3-yl)-2-methylpiperidine-1-sulfonamide
CID 55682031
(2R)-N-[2-(2-methoxyphenyl)ethyl]-2-methylpiperidine-1-sulfonamide
CID 35308806

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-phenacylpiperidine-1-sulfonamide?
The IUPAC name of 2-methyl-N-phenacylpiperidine-1-sulfonamide (CID 64994247) is 2-methyl-N-phenacylpiperidine-1-sulfonamide.
What is the SMILES notation for 2-methyl-N-phenacylpiperidine-1-sulfonamide?
The canonical SMILES for 2-methyl-N-phenacylpiperidine-1-sulfonamide is CC1CCCCN1S(=O)(=O)NCC(=O)c1ccccc1.
What is the InChIKey of 2-methyl-N-phenacylpiperidine-1-sulfonamide?
The InChIKey is AVZCPPRJAPWNQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-12-7-5-6-10-16(12)20(18,19)15-11-14(17)13-8-3-2-4-9-13/h2-4,8-9,12,15H,5-7,10-11H2,1H3.
What are the key properties of 2-methyl-N-phenacylpiperidine-1-sulfonamide?
2-methyl-N-phenacylpiperidine-1-sulfonamide has a molecular weight of 296.39 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-phenacylpiperidine-1-sulfonamide is sourced from PubChem (CID 64994247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).