2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide

C15H23N3O3S — CID 119278332

IUPAC2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide
SMILESCCS(=O)(=O)N1CCC(NC(=O)C(N)c2ccccc2)CC1
InChIInChI=1S/C15H23N3O3S/c1-2-22(20,21)18-10-8-13(9-11-18)17-15(19)14(16)12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,16H2,1H3,(H,17,19)
InChIKeyRZTHXYZTTIBDOQ-UHFFFAOYSA-N
MW325.43 g/mol
LogP0.62
Rot. Bonds5

About 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide

2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide (PubChem CID 119278332) has the molecular formula C15H23N3O3S and a molecular weight of 325.43 g/mol. Its IUPAC name is 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide
PubChem CID119278332
Molecular FormulaC15H23N3O3S
Molecular Weight325.43 g/mol
Exact Mass325.15
IUPAC Name2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide
SMILESCCS(=O)(=O)N1CCC(NC(=O)C(N)c2ccccc2)CC1
InChIInChI=1S/C15H23N3O3S/c1-2-22(20,21)18-10-8-13(9-11-18)17-15(19)14(16)12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,16H2,1H3,(H,17,19)
InChIKeyRZTHXYZTTIBDOQ-UHFFFAOYSA-N
XLogP0.62
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.43
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-(1-methylsulfonylpiperidin-4-yl)-2-phenylacetamide
CID 104897197
(2S)-2-amino-2-phenyl-N-(1-propylpiperidin-4-yl)acetamide
CID 104897650
2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-thiophen-2-ylacetamide
CID 115286975
4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide
CID 56867282
(2R)-2-amino-N-cycloheptyl-2-phenylacetamide
CID 61148121
2-amino-2-phenyl-N-(1-prop-2-enylpiperidin-4-yl)acetamide
CID 119879084
2-amino-N-(1-cyclopropylsulfonylpiperidin-4-yl)-2-(4-methylphenyl)acetamide
CID 120669080
2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2-phenylacetamide;hydrochloride
CID 119278567
(2R)-2-amino-N-(1-ethylpiperidin-3-yl)-2-phenylacetamide
CID 61169816
3-amino-N-(1-methylsulfonylpiperidin-4-yl)-2-phenylpropanamide
CID 119699916
2-amino-N-(4-aminocyclohexyl)-2-phenylacetamide
CID 62320729
N-(1-ethylsulfonylpiperidin-4-yl)-3-phenylpropanamide
CID 33220250

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide?
The IUPAC name of 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide (CID 119278332) is 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide?
The canonical SMILES for 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide is CCS(=O)(=O)N1CCC(NC(=O)C(N)c2ccccc2)CC1.
What is the InChIKey of 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide?
The InChIKey is RZTHXYZTTIBDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3S/c1-2-22(20,21)18-10-8-13(9-11-18)17-15(19)14(16)12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,16H2,1H3,(H,17,19).
What are the key properties of 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide?
2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide has a molecular weight of 325.43 g/mol, XLogP of 0.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide is sourced from PubChem (CID 119278332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).