(2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine

C12H19N3 — CID 30075732

IUPAC(2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine
SMILESNC[C@H](c1cccnc1)N1CCCCC1
InChIInChI=1S/C12H19N3/c13-9-12(11-5-4-6-14-10-11)15-7-2-1-3-8-15/h4-6,10,12H,1-3,7-9,13H2/t12-/m1/s1
InChIKeyCIIUJLFQGCDIQU-GFCCVEGCSA-N
MW205.31 g/mol
LogP1.57
Rot. Bonds3

About (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine

(2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine (PubChem CID 30075732) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name(2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine
PubChem CID30075732
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name(2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine
SMILESNC[C@H](c1cccnc1)N1CCCCC1
InChIInChI=1S/C12H19N3/c13-9-12(11-5-4-6-14-10-11)15-7-2-1-3-8-15/h4-6,10,12H,1-3,7-9,13H2/t12-/m1/s1
InChIKeyCIIUJLFQGCDIQU-GFCCVEGCSA-N
XLogP1.57
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-3-yl-2-pyrrolidin-1-ylethanethiol
CID 142393925
3-(2-chloro-1-pyrrolidin-1-ylethyl)pyridine
CID 82078027
(2S)-2-piperidin-1-yl-2-pyridin-4-ylethanamine
CID 39254713
(3S)-3-piperidin-1-yl-3-pyridin-3-ylpropanoic acid
CID 92864030
1-(2-piperazin-1-yl-1-pyridin-3-ylethyl)azepane
CID 82201767
2-(azocan-1-yl)-2-(6-methyl-3-pyridinyl)ethanamine
CID 113457077
[1-(2-amino-1-pyridin-3-ylethyl)pyrrolidin-3-yl]methanol
CID 112624351
3-[(1S,2R)-2-pyridin-3-yl-1,2-dipyrrolidin-1-ylethyl]pyridine
CID 11163071
2-(2-methylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine
CID 60973443
2-(2-ethylpiperidin-1-yl)-2-pyridin-3-ylethanamine
CID 43266319
2-(2,6-dimethylpiperidin-1-yl)-2-pyridin-3-ylethanamine
CID 82041284
N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)oxan-4-amine
CID 131944543

Frequently Asked Questions

What is the IUPAC name of (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine?
The IUPAC name of (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine (CID 30075732) is (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine.
What is the SMILES notation for (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine?
The canonical SMILES for (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine is NC[C@H](c1cccnc1)N1CCCCC1.
What is the InChIKey of (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine?
The InChIKey is CIIUJLFQGCDIQU-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H19N3/c13-9-12(11-5-4-6-14-10-11)15-7-2-1-3-8-15/h4-6,10,12H,1-3,7-9,13H2/t12-/m1/s1.
What are the key properties of (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine?
(2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine has a molecular weight of 205.31 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine is sourced from PubChem (CID 30075732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).