N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine

C12H19N3 — CID 81401330

IUPACN-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine
SMILESC[C@H](NC1CCNCC1)c1ccccn1
InChIInChI=1S/C12H19N3/c1-10(12-4-2-3-7-14-12)15-11-5-8-13-9-6-11/h2-4,7,10-11,13,15H,5-6,8-9H2,1H3/t10-/m0/s1
InChIKeyCDUJSRKGPBLLBY-JTQLQIEISA-N
MW205.31 g/mol
LogP1.48
Rot. Bonds3

About N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine

N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine (PubChem CID 81401330) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine.

Molecular Properties

Compound NameN-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine
PubChem CID81401330
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine
SMILESC[C@H](NC1CCNCC1)c1ccccn1
InChIInChI=1S/C12H19N3/c1-10(12-4-2-3-7-14-12)15-11-5-8-13-9-6-11/h2-4,7,10-11,13,15H,5-6,8-9H2,1H3/t10-/m0/s1
InChIKeyCDUJSRKGPBLLBY-JTQLQIEISA-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

Analyze N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine
CID 71637667
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
(3S)-N-(1-pyridin-2-ylethyl)piperidin-3-amine
CID 71637655
(3R)-N-(1-pyridin-2-ylethyl)piperidin-3-amine;hydrochloride
CID 71637625
1,1-dioxo-N-(1-pyridin-2-ylethyl)thian-4-amine
CID 43511597
1-[4-(1-pyridin-2-ylethylamino)piperidin-1-yl]ethanone
CID 43223671
1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine
CID 106820380
3,5-dimethyl-N-(1-pyridin-2-ylethyl)cyclohexan-1-amine
CID 64723808
3-methyl-N-[(1S)-1-pyridin-2-ylethyl]cyclohexan-1-amine
CID 81402334
3,4-dimethyl-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine
CID 81401419

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine?
The IUPAC name of N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine (CID 81401330) is N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine.
What is the SMILES notation for N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine?
The canonical SMILES for N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine is C[C@H](NC1CCNCC1)c1ccccn1.
What is the InChIKey of N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine?
The InChIKey is CDUJSRKGPBLLBY-JTQLQIEISA-N. The full InChI is InChI=1S/C12H19N3/c1-10(12-4-2-3-7-14-12)15-11-5-8-13-9-6-11/h2-4,7,10-11,13,15H,5-6,8-9H2,1H3/t10-/m0/s1.
What are the key properties of N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine?
N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-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 N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine is sourced from PubChem (CID 81401330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).