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885499-57-0 | 1-(1H-Pyrrolo[2,3-b]pyridin-4-yl)piperidin-4-amine
CAS No: 885499-57-0 Catalog No: AG004DOV MDL No:MFCD11616364
Product Description
Catalog Number:
AG004DOV
Chemical Name:
1-(1H-Pyrrolo[2,3-b]pyridin-4-yl)piperidin-4-amine
CAS Number:
885499-57-0
Molecular Formula:
C12H16N4
Molecular Weight:
216.2822
MDL Number:
MFCD11616364
IUPAC Name:
1-(1H-pyrrolo[2,3-b]pyridin-4-yl)piperidin-4-amine
InChI:
InChI=1S/C12H16N4/c13-9-3-7-16(8-4-9)11-2-6-15-12-10(11)1-5-14-12/h1-2,5-6,9H,3-4,7-8,13H2,(H,14,15)
InChI Key:
ZFBACGKIDNXYRK-UHFFFAOYSA-N
SMILES:
NC1CCN(CC1)c1ccnc2c1cc[nH]2
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.288g/mol
Monoisotopic Mass:
216.137g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Identification of 4-(4-aminopiperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidines as selective inhibitors of protein kinase B through fragment elaboration. | Journal of medicinal chemistry 20080410 |
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