Home Aminos ethyl 3-{[(pyridin-3-yl)methyl]amino}propanoate

ethyl 3-{[(pyridin-3-yl)methyl]amino}propanoate

CAS No.:
1040688-05-8
Catalog Number:
AG00JT5N
Molecular Formula:
C11H16N2O2
Molecular Weight:
208.2569
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Product Description
Catalog Number:
AG00JT5N
Chemical Name:
ethyl 3-{[(pyridin-3-yl)methyl]amino}propanoate
CAS Number:
1040688-05-8
Molecular Formula:
C11H16N2O2
Molecular Weight:
208.2569
MDL Number:
MFCD10687258
IUPAC Name:
ethyl 3-(pyridin-3-ylmethylamino)propanoate
InChI:
InChI=1S/C11H16N2O2/c1-2-15-11(14)5-7-13-9-10-4-3-6-12-8-10/h3-4,6,8,13H,2,5,7,9H2,1H3
InChI Key:
PASHPBRYVXNGTI-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCNCc1cccnc1
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.121g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.261g/mol
Monoisotopic Mass:
208.121g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties