[1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine

C13H21N3 — CID 63262844

IUPAC[1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine
SMILESNCC1CCCCN1CCc1cccnc1
InChIInChI=1S/C13H21N3/c14-10-13-5-1-2-8-16(13)9-6-12-4-3-7-15-11-12/h3-4,7,11,13H,1-2,5-6,8-10,14H2
InChIKeyUFZISYHSMKHQAJ-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.44
Rot. Bonds4

About [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine

[1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine (PubChem CID 63262844) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine
PubChem CID63262844
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name[1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine
SMILESNCC1CCCCN1CCc1cccnc1
InChIInChI=1S/C13H21N3/c14-10-13-5-1-2-8-16(13)9-6-12-4-3-7-15-11-12/h3-4,7,11,13H,1-2,5-6,8-10,14H2
InChIKeyUFZISYHSMKHQAJ-UHFFFAOYSA-N
XLogP1.44
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(2-pyridin-3-ylethyl)piperidin-2-yl]methyl]propan-2-amine
CID 63848353
2-[1-(pyridin-3-ylmethyl)piperidin-2-yl]ethanamine
CID 63759147
3-[[(2S)-1-(3-methylbutyl)pyrrolidin-2-yl]methyl]pyridine
CID 59085007
3-(2-pyrrolidin-1-ylethyl)pyridine
CID 23273673
3-[(2-ethylpiperidin-1-yl)methyl]pyridine
CID 47021485
[(2R,3R)-2-methyl-1-(pyridin-3-ylmethyl)azepan-3-yl]methanamine
CID 96597473
3-methyl-1-(2-pyridin-3-ylethyl)piperidine-2-carboxylic acid
CID 107072568
3-[2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)ethyl]pyridine
CID 63262845
3-[2-[(2S)-2-(5-methylfuran-2-yl)pyrrolidin-1-yl]ethyl]pyridine
CID 124742750
2-[1-(pyridin-3-ylmethyl)piperidin-2-yl]acetonitrile
CID 117028174
[1-(2-pyridin-4-ylethyl)piperidin-2-yl]methanol
CID 60649309
N'-hydroxy-1-(pyridin-3-ylmethyl)piperidine-2-carboximidamide
CID 77041710

Frequently Asked Questions

What is the IUPAC name of [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine?
The IUPAC name of [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine (CID 63262844) is [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine.
What is the SMILES notation for [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine?
The canonical SMILES for [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine is NCC1CCCCN1CCc1cccnc1.
What is the InChIKey of [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine?
The InChIKey is UFZISYHSMKHQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c14-10-13-5-1-2-8-16(13)9-6-12-4-3-7-15-11-12/h3-4,7,11,13H,1-2,5-6,8-10,14H2.
What are the key properties of [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine?
[1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine has a molecular weight of 219.33 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine is sourced from PubChem (CID 63262844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).