(3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine

C12H19N3 — CID 71637655

IUPAC(3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine
SMILESCC(N[C@H]1CCCNC1)c1ccccn1
InChIInChI=1S/C12H19N3/c1-10(12-6-2-3-8-14-12)15-11-5-4-7-13-9-11/h2-3,6,8,10-11,13,15H,4-5,7,9H2,1H3/t10?,11-/m0/s1
InChIKeyQUGGAGOEWKZEHW-DTIOYNMSSA-N
MW205.31 g/mol
LogP1.48
Rot. Bonds3

About (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine

(3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine (PubChem CID 71637655) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine.

Molecular Properties

Compound Name(3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine
PubChem CID71637655
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name(3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine
SMILESCC(N[C@H]1CCCNC1)c1ccccn1
InChIInChI=1S/C12H19N3/c1-10(12-6-2-3-8-14-12)15-11-5-4-7-13-9-11/h2-3,6,8,10-11,13,15H,4-5,7,9H2,1H3/t10?,11-/m0/s1
InChIKeyQUGGAGOEWKZEHW-DTIOYNMSSA-N
XLogP1.48
TPSA36.95 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 ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-(1-pyridin-2-ylethyl)piperidin-3-amine;hydrochloride
CID 71637625
(3S)-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine
CID 71637667
N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine
CID 81401330
N-[(1S)-1-pyridin-2-ylethyl]cyclododecanamine
CID 29052683
N-[(1S)-1-pyridin-2-ylethyl]cycloheptanamine
CID 28647798
N-(1-pyridin-2-ylethyl)cyclooctanamine
CID 43178142
(3R)-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-3-amine
CID 97162191
(3S)-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
CID 81407106
3-methyl-N-[(1S)-1-pyridin-2-ylethyl]cyclohexan-1-amine
CID 81402334
1-methyl-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine
CID 61461637
N-[(1R)-1-(2-methylphenyl)ethyl]piperidin-3-amine
CID 81373256
N-[(1R)-1-pyridin-2-ylethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 81401806

Frequently Asked Questions

What is the IUPAC name of (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine?
The IUPAC name of (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine (CID 71637655) is (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine.
What is the SMILES notation for (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine?
The canonical SMILES for (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine is CC(N[C@H]1CCCNC1)c1ccccn1.
What is the InChIKey of (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine?
The InChIKey is QUGGAGOEWKZEHW-DTIOYNMSSA-N. The full InChI is InChI=1S/C12H19N3/c1-10(12-6-2-3-8-14-12)15-11-5-4-7-13-9-11/h2-3,6,8,10-11,13,15H,4-5,7,9H2,1H3/t10?,11-/m0/s1.
What are the key properties of (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine?
(3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine has a molecular weight of 205.31 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine is sourced from PubChem (CID 71637655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).