Home Carboxys tert-butyl 4-[(prop-2-yn-1-yl)carbamoyl]piperidine-1-carboxylate

tert-butyl 4-[(prop-2-yn-1-yl)carbamoyl]piperidine-1-carboxylate

CAS No.:
1030181-52-2
Catalog Number:
AG01B931
Molecular Formula:
C14H22N2O3
Molecular Weight:
266.3361
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Product Description
Catalog Number:
AG01B931
Chemical Name:
tert-butyl 4-[(prop-2-yn-1-yl)carbamoyl]piperidine-1-carboxylate
CAS Number:
1030181-52-2
Molecular Formula:
C14H22N2O3
Molecular Weight:
266.3361
MDL Number:
MFCD10605357
IUPAC Name:
tert-butyl 4-(prop-2-ynylcarbamoyl)piperidine-1-carboxylate
InChI:
InChI=1S/C14H22N2O3/c1-5-8-15-12(17)11-6-9-16(10-7-11)13(18)19-14(2,3)4/h1,11H,6-10H2,2-4H3,(H,15,17)
InChI Key:
XYNQIICDAJZIHK-UHFFFAOYSA-N
SMILES:
C#CCNC(=O)C1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
381  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.163g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
266.341g/mol
Monoisotopic Mass:
266.163g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties