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27262-40-4 | (S)-N-(2,6-Dimethylphenyl)-2-piperidinecarboxamide
CAS No: 27262-40-4 Catalog No: AG0039W7 MDL No:MFCD09038786
Product Description
Catalog Number:
AG0039W7
Chemical Name:
(S)-N-(2,6-Dimethylphenyl)-2-piperidinecarboxamide
CAS Number:
27262-40-4
Molecular Formula:
C14H20N2O
Molecular Weight:
232.3214
MDL Number:
MFCD09038786
IUPAC Name:
(2S)-N-(2,6-dimethylphenyl)piperidine-2-carboxamide
InChI:
InChI=1S/C14H20N2O/c1-10-6-5-7-11(2)13(10)16-14(17)12-8-3-4-9-15-12/h5-7,12,15H,3-4,8-9H2,1-2H3,(H,16,17)/t12-/m0/s1
InChI Key:
SILRCGDPZGQJOQ-LBPRGKRZSA-N
SMILES:
O=C([C@@H]1CCCCN1)Nc1c(C)cccc1C
EC Number:
608-069-4
UNII:
4A8HC6M4AL
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
232.158g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.327g/mol
Monoisotopic Mass:
232.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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