4-[(1S)-1-piperidin-1-ylethyl]pyridine

C12H18N2 — CID 11286966

IUPAC4-[(1S)-1-piperidin-1-ylethyl]pyridine
SMILESC[C@@H](c1ccncc1)N1CCCCC1
InChIInChI=1S/C12H18N2/c1-11(12-5-7-13-8-6-12)14-9-3-2-4-10-14/h5-8,11H,2-4,9-10H2,1H3/t11-/m0/s1
InChIKeyBLEYRRHUQHTWTI-NSHDSACASA-N
MW190.29 g/mol
LogP2.63
Rot. Bonds2

About 4-[(1S)-1-piperidin-1-ylethyl]pyridine

4-[(1S)-1-piperidin-1-ylethyl]pyridine (PubChem CID 11286966) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 4-[(1S)-1-piperidin-1-ylethyl]pyridine.

Molecular Properties

Compound Name4-[(1S)-1-piperidin-1-ylethyl]pyridine
PubChem CID11286966
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name4-[(1S)-1-piperidin-1-ylethyl]pyridine
SMILESC[C@@H](c1ccncc1)N1CCCCC1
InChIInChI=1S/C12H18N2/c1-11(12-5-7-13-8-6-12)14-9-3-2-4-10-14/h5-8,11H,2-4,9-10H2,1H3/t11-/m0/s1
InChIKeyBLEYRRHUQHTWTI-NSHDSACASA-N
XLogP2.63
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-[(1S)-1-piperidin-1-ylethyl]pyridine 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

1-[(1S)-1-pyridin-4-ylethyl]piperazine;dihydrochloride
CID 171274136
1-[4-(1-pyrrolidin-1-ylethyl)phenyl]ethanamine;hydrochloride
CID 67217460
5-[4-(1-pyridin-4-ylethyl)piperazin-1-yl]pyrimidine
CID 110454906
1-[1-(4-bromophenyl)ethyl]pyrrolidine
CID 12738008
3-[4-[4-(1-pyrrolidin-1-ylethyl)phenyl]phenyl]pyridine
CID 11602342
4-[4-[4-[(1R)-1-pyrrolidin-1-ylethyl]phenyl]-1H-pyrazol-5-yl]pyridine
CID 126428744
3-methyl-1-(1-pyridin-4-ylethyl)piperidine-3-carboxylic acid
CID 65068572
propan-2-yl 1-(1-pyridin-4-ylethyl)piperidine-4-carboxylate
CID 20754611
1-[4-(1-pyridin-4-ylethyl)piperazin-1-yl]propan-1-one
CID 110459300
N-ethyl-1-(1-pyridin-4-ylethyl)piperidin-4-amine
CID 60860637
2,2-dimethyl-1-[4-(1-pyridin-4-ylethyl)piperazin-1-yl]propan-1-one
CID 110460739
1-[1-(4-bromophenyl)ethyl]pyrrolidine;hydrochloride
CID 119032014

Frequently Asked Questions

What is the IUPAC name of 4-[(1S)-1-piperidin-1-ylethyl]pyridine?
The IUPAC name of 4-[(1S)-1-piperidin-1-ylethyl]pyridine (CID 11286966) is 4-[(1S)-1-piperidin-1-ylethyl]pyridine.
What is the SMILES notation for 4-[(1S)-1-piperidin-1-ylethyl]pyridine?
The canonical SMILES for 4-[(1S)-1-piperidin-1-ylethyl]pyridine is C[C@@H](c1ccncc1)N1CCCCC1.
What is the InChIKey of 4-[(1S)-1-piperidin-1-ylethyl]pyridine?
The InChIKey is BLEYRRHUQHTWTI-NSHDSACASA-N. The full InChI is InChI=1S/C12H18N2/c1-11(12-5-7-13-8-6-12)14-9-3-2-4-10-14/h5-8,11H,2-4,9-10H2,1H3/t11-/m0/s1.
What are the key properties of 4-[(1S)-1-piperidin-1-ylethyl]pyridine?
4-[(1S)-1-piperidin-1-ylethyl]pyridine has a molecular weight of 190.29 g/mol, XLogP of 2.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1S)-1-piperidin-1-ylethyl]pyridine is sourced from PubChem (CID 11286966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).