Home Carboxys 1-(methylcarbamoyl)piperidine-4-carboxylic acid

1-(methylcarbamoyl)piperidine-4-carboxylic acid

CAS No.:
1094413-31-6
Catalog Number:
AG01EK77
Molecular Formula:
C8H14N2O3
Molecular Weight:
186.2084
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Product Description
Catalog Number:
AG01EK77
Chemical Name:
1-(methylcarbamoyl)piperidine-4-carboxylic acid
CAS Number:
1094413-31-6
Molecular Formula:
C8H14N2O3
Molecular Weight:
186.2084
MDL Number:
MFCD11164849
IUPAC Name:
1-(methylcarbamoyl)piperidine-4-carboxylic acid
InChI:
InChI=1S/C8H14N2O3/c1-9-8(13)10-4-2-6(3-5-10)7(11)12/h6H,2-5H2,1H3,(H,9,13)(H,11,12)
InChI Key:
XCXXOQIGAOCJFQ-UHFFFAOYSA-N
SMILES:
CNC(=O)N1CCC(CC1)C(=O)O
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.1g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.211g/mol
Monoisotopic Mass:
186.1g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties