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Ethyl 4-((2-(1-piperidinyl)acetyl)amino)benzoate

HCID 3300
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
41653-21-8
Standard SMILES
CCOC(=O)c1ccc(NC(=O)CN2CCCCC2)cc1
InChIKey
QLGIFPJNYPWBMQ-UHFFFAOYSA-N
Molecular formula
C16H22N2O3
Average molar mass
290.36 g/mol
Monoisotopic mass
290.16304257

Overview

Ethyl piperidinoacetylaminobenzoate is a member of piperidines and a benzoate ester. It is functionally related to an acetamide.

Names & identifiers

Preferred name
Ethyl 4-((2-(1-piperidinyl)acetyl)amino)benzoate
IUPAC
ethyl 4-[(2-piperidin-1-ylacetyl)amino]benzoate
English name
Ethyl piperidinoacetylaminobenzoate
Molecular formula
C16H22N2O3
Molecular weight
290.36

Names & synonyms

Ethyl piperidinoacetylaminobenzoate41653-21-8SulcainNichicaineEPAB6M452G7O1FEthyl p-(piperidinoacetylamino)benzoateCHEBI:31576Ethyl 4-[[2-(1-piperidinyl)acetyl]amino]benzoateEthyl 4-((2-(1-piperidinyl)acetyl)amino)benzoateRefChem:1084894Sulcaine
Show more names
p-(2-Piperidinoacetylamino)benzoic acid ethyl ester4-[(Piperidinoacetyl)amino]benzoic acid ethyl ester4-[(1-Piperidinylacetyl)amino]benzoic acid ethyl esterBenzoic acid, 4-[[2-(1-piperidinyl)acetyl]amino]-, ethyl ester
ethyl 4-[(2-piperidin-1-ylacetyl)amino]benzoateDTXSID4048850Ethylpiperidinoacetylaminobenzoatep-(Piperidinoacetamide)benzoic acid ethyl esterEthyl piperidinoacetylaminobenzoate [JAN]ethyl 4-[2-(piperidin-1-yl)acetamido]benzoateNCGC00181909-01Ethyl 4-(2-(piperidin-1-yl)acetamido)benzoate

Database identifiers

CAS
41653-21-8
PubChem CID
3300
DTXSID
DTXSID4048850
ChEMBL
CHEMBL2106245
ChEBI
CHEBI:31576
UNII
6M452G7O1F
Nikkaji
J87.242C

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
58.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
21
Formal charge
0
Complexity
345

Physicochemical properties

FDA UNII
6 M452G7O1F · 6M452G7O1F

Chemistry & industry

Suppliers1 total

重庆卡兰医药有限公司[email protected]

Additional notes

DefinitionChEBI: Ethyl piperidinoacetylaminobenzoate is a benzoate ester and a member of piperidines. It is functionally related to an acetamide.

Related reactions

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Compound notes

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