2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine

C12H19N3 — CID 28845965

IUPAC2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine
SMILESC[C@@H]1C[C@H](C)CN(c2ncccc2N)C1
InChIInChI=1S/C12H19N3/c1-9-6-10(2)8-15(7-9)12-11(13)4-3-5-14-12/h3-5,9-10H,6-8,13H2,1-2H3/t9-,10+
InChIKeyCWNKGXSVOUKHTA-AOOOYVTPSA-N
MW205.31 g/mol
LogP2.15
Rot. Bonds1

About 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine

2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine (PubChem CID 28845965) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine.

Molecular Properties

Compound Name2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine
PubChem CID28845965
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine
SMILESC[C@@H]1C[C@H](C)CN(c2ncccc2N)C1
InChIInChI=1S/C12H19N3/c1-9-6-10(2)8-15(7-9)12-11(13)4-3-5-14-12/h3-5,9-10H,6-8,13H2,1-2H3/t9-,10+
InChIKeyCWNKGXSVOUKHTA-AOOOYVTPSA-N
XLogP2.15
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethoxypyrrolidin-1-yl)pyridin-3-amine
CID 103530537
2-(2,3,5-trimethylpiperidin-1-yl)pyridin-3-amine
CID 114591996
3-(chloromethyl)-2-(3,5-dimethylpiperidin-1-yl)pyridine
CID 61256999
[(3S,4S)-1-(3-amino-2-pyridinyl)-4-methylpyrrolidin-3-yl]methanol
CID 129497788
3-iodo-2-(3-methylazetidin-1-yl)pyridine
CID 170381224
2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine
CID 66391110
(3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol
CID 129359554
(3R,4R)-1-(3-amino-2-pyridinyl)-3-methylpiperidin-4-ol
CID 129445700
3-chloro-2-(3-methylazetidin-1-yl)pyridine
CID 103094608
6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine
CID 43809501
2-(azocan-1-yl)pyridin-3-amine
CID 28799710
2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine
CID 63610642

Frequently Asked Questions

What is the IUPAC name of 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine?
The IUPAC name of 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine (CID 28845965) is 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine.
What is the SMILES notation for 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine?
The canonical SMILES for 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine is C[C@@H]1C[C@H](C)CN(c2ncccc2N)C1.
What is the InChIKey of 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine?
The InChIKey is CWNKGXSVOUKHTA-AOOOYVTPSA-N. The full InChI is InChI=1S/C12H19N3/c1-9-6-10(2)8-15(7-9)12-11(13)4-3-5-14-12/h3-5,9-10H,6-8,13H2,1-2H3/t9-,10+.
What are the key properties of 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine?
2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine has a molecular weight of 205.31 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine is sourced from PubChem (CID 28845965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).