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832676-76-3 | Propanamide, 2-[[(2-amino-3-methoxyphenyl)methyl]amino]-
CAS No: 832676-76-3 Catalog No: AG004YYD MDL No:
Product Description
Catalog Number:
AG004YYD
Chemical Name:
Propanamide, 2-[[(2-amino-3-methoxyphenyl)methyl]amino]-
CAS Number:
832676-76-3
Molecular Formula:
C11H17N3O2
Molecular Weight:
223.2716
IUPAC Name:
2-[(2-amino-3-methoxyphenyl)methylamino]propanamide
InChI:
InChI=1S/C11H17N3O2/c1-7(11(13)15)14-6-8-4-3-5-9(16-2)10(8)12/h3-5,7,14H,6,12H2,1-2H3,(H2,13,15)
InChI Key:
LWSGHXCEMVXCBA-UHFFFAOYSA-N
SMILES:
CC(C(=O)N)NCc1cccc(c1N)OC
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.132g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
223.276g/mol
Monoisotopic Mass:
223.132g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
90.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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