1-piperidin-3-yl-2-pyridin-3-ylethanamine

C12H19N3 — CID 82396184

IUPAC1-piperidin-3-yl-2-pyridin-3-ylethanamine
SMILESNC(Cc1cccnc1)C1CCCNC1
InChIInChI=1S/C12H19N3/c13-12(11-4-2-6-15-9-11)7-10-3-1-5-14-8-10/h1,3,5,8,11-12,15H,2,4,6-7,9,13H2
InChIKeyJKVGKKCUIPZJIH-UHFFFAOYSA-N
MW205.31 g/mol
LogP0.95
Rot. Bonds3

About 1-piperidin-3-yl-2-pyridin-3-ylethanamine

1-piperidin-3-yl-2-pyridin-3-ylethanamine (PubChem CID 82396184) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 1-piperidin-3-yl-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-piperidin-3-yl-2-pyridin-3-ylethanamine
PubChem CID82396184
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name1-piperidin-3-yl-2-pyridin-3-ylethanamine
SMILESNC(Cc1cccnc1)C1CCCNC1
InChIInChI=1S/C12H19N3/c13-12(11-4-2-6-15-9-11)7-10-3-1-5-14-8-10/h1,3,5,8,11-12,15H,2,4,6-7,9,13H2
InChIKeyJKVGKKCUIPZJIH-UHFFFAOYSA-N
XLogP0.95
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-2-pyridin-3-ylethanamine
CID 62553066
2-pyridin-3-yl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 104736415
(3S)-N-(pyridin-3-ylmethyl)piperidin-3-amine
CID 53256527
3-[2,2-di(cyclobutyl)ethyl]pyridine
CID 57256962
N-piperidin-3-yl-2-pyridin-3-ylacetamide
CID 63321155
1-cyclopropyl-3-pyridin-3-ylpropan-2-amine
CID 64906812
1-(4-butylcyclohexyl)-2-pyridin-3-ylethanamine
CID 105034554
(3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride
CID 71636735
3-piperidin-3-yl-1-pyridin-3-ylbutan-1-one
CID 116594349
[3-methyl-4-(1-piperidin-3-yl-2-pyridin-3-ylethoxy)-1-benzofuran-2-yl]methanol
CID 22614970
(1S)-1-cyclobutyl-2-phenylethanamine;phosphane
CID 143108875
3-[[(3R)-piperidin-3-yl]methylsulfonylmethyl]pyridine
CID 97165999

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-3-yl-2-pyridin-3-ylethanamine?
The IUPAC name of 1-piperidin-3-yl-2-pyridin-3-ylethanamine (CID 82396184) is 1-piperidin-3-yl-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-piperidin-3-yl-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-piperidin-3-yl-2-pyridin-3-ylethanamine is NC(Cc1cccnc1)C1CCCNC1.
What is the InChIKey of 1-piperidin-3-yl-2-pyridin-3-ylethanamine?
The InChIKey is JKVGKKCUIPZJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c13-12(11-4-2-6-15-9-11)7-10-3-1-5-14-8-10/h1,3,5,8,11-12,15H,2,4,6-7,9,13H2.
What are the key properties of 1-piperidin-3-yl-2-pyridin-3-ylethanamine?
1-piperidin-3-yl-2-pyridin-3-ylethanamine has a molecular weight of 205.31 g/mol, XLogP of 0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-3-yl-2-pyridin-3-ylethanamine is sourced from PubChem (CID 82396184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).