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865075-31-6 | {1-[2-(Pyridin-4-yl)ethyl]piperidin-4-yl}methanamine
CAS No: 865075-31-6 Catalog No: AG01F8MT MDL No:MFCD06637737
Product Description
Catalog Number:
AG01F8MT
Chemical Name:
{1-[2-(Pyridin-4-yl)ethyl]piperidin-4-yl}methanamine
CAS Number:
865075-31-6
Molecular Formula:
C13H21N3
Molecular Weight:
219.3259
MDL Number:
MFCD06637737
IUPAC Name:
[1-(2-pyridin-4-ylethyl)piperidin-4-yl]methanamine
InChI:
InChI=1S/C13H21N3/c14-11-13-4-9-16(10-5-13)8-3-12-1-6-15-7-2-12/h1-2,6-7,13H,3-5,8-11,14H2
InChI Key:
YHZKEGRGKHWNQJ-UHFFFAOYSA-N
SMILES:
NCC1CCN(CC1)CCc1ccncc1
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.174g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.332g/mol
Monoisotopic Mass:
219.174g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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