(3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine

C11H16FN3 — CID 167387457

IUPAC(3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine
SMILESCc1ncc([C@@H]2CC[C@H](N)CN2)cc1F
InChIInChI=1S/C11H16FN3/c1-7-10(12)4-8(5-14-7)11-3-2-9(13)6-15-11/h4-5,9,11,15H,2-3,6,13H2,1H3/t9-,11-/m0/s1
InChIKeyFCKMKZVXXNBWQK-ONGXEEELSA-N
MW209.27 g/mol
LogP1.28
Rot. Bonds1

About (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine

(3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine (PubChem CID 167387457) has the molecular formula C11H16FN3 and a molecular weight of 209.27 g/mol. Its IUPAC name is (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine.

Molecular Properties

Compound Name(3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine
PubChem CID167387457
Molecular FormulaC11H16FN3
Molecular Weight209.27 g/mol
Exact Mass209.13
IUPAC Name(3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine
SMILESCc1ncc([C@@H]2CC[C@H](N)CN2)cc1F
InChIInChI=1S/C11H16FN3/c1-7-10(12)4-8(5-14-7)11-3-2-9(13)6-15-11/h4-5,9,11,15H,2-3,6,13H2,1H3/t9-,11-/m0/s1
InChIKeyFCKMKZVXXNBWQK-ONGXEEELSA-N
XLogP1.28
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Anabasine
CID 205586
(+-)-Anabasine
CID 2181
5,5'-Dimethyl-2,2'-bipyridyl
CID 15664
Lanicemine
CID 9794203
(-)-Anatabine
CID 11388
4,4'-Dimethyl-2,2'-bipyridine
CID 14338
2,3'-Bipyridine
CID 11389
(+-)-1,2,3,6-Tetrahydro-2,3'-bipyridine
CID 261474
2,4'-Bipyridine
CID 68488
1-Methyl-2-(3-pyridyl)piperidine
CID 29758
3-((2R)-Piperidin-2-Yl)Pyridine
CID 641266
BC-1215
CID 72201045

Frequently Asked Questions

What is the IUPAC name of (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine?
The IUPAC name of (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine (CID 167387457) is (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine.
What is the SMILES notation for (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine?
The canonical SMILES for (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine is Cc1ncc([C@@H]2CC[C@H](N)CN2)cc1F.
What is the InChIKey of (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine?
The InChIKey is FCKMKZVXXNBWQK-ONGXEEELSA-N. The full InChI is InChI=1S/C11H16FN3/c1-7-10(12)4-8(5-14-7)11-3-2-9(13)6-15-11/h4-5,9,11,15H,2-3,6,13H2,1H3/t9-,11-/m0/s1.
What are the key properties of (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine?
(3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine has a molecular weight of 209.27 g/mol, XLogP of 1.28, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,6S)-6-(5-fluoro-6-methyl-3-pyridinyl)piperidin-3-amine is sourced from PubChem (CID 167387457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).