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821784-81-0 | Benzamide, 3-[5-[(2-pyrrolidinylmethyl)amino]-3-pyridinyl]-
CAS No: 821784-81-0 Catalog No: AG00578Q MDL No:
Product Description
Catalog Number:
AG00578Q
Chemical Name:
Benzamide, 3-[5-[(2-pyrrolidinylmethyl)amino]-3-pyridinyl]-
CAS Number:
821784-81-0
Molecular Formula:
C17H20N4O
Molecular Weight:
296.3669
IUPAC Name:
3-[5-(pyrrolidin-2-ylmethylamino)pyridin-3-yl]benzamide
InChI:
InChI=1S/C17H20N4O/c18-17(22)13-4-1-3-12(7-13)14-8-16(10-19-9-14)21-11-15-5-2-6-20-15/h1,3-4,7-10,15,20-21H,2,5-6,11H2,(H2,18,22)
InChI Key:
LMVDLAKTHWHLGE-UHFFFAOYSA-N
SMILES:
NC(=O)c1cccc(c1)c1cncc(c1)NCC1CCCN1
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.164g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
296.374g/mol
Monoisotopic Mass:
296.164g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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