4-[(4-ethenylpiperidin-1-yl)methyl]pyridine

C13H18N2 — CID 142137767

IUPAC4-[(4-ethenylpiperidin-1-yl)methyl]pyridine
SMILESC=CC1CCN(Cc2ccncc2)CC1
InChIInChI=1S/C13H18N2/c1-2-12-5-9-15(10-6-12)11-13-3-7-14-8-4-13/h2-4,7-8,12H,1,5-6,9-11H2
InChIKeyRTZHLUMNSQPJPL-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.48
Rot. Bonds3

About 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine

4-[(4-ethenylpiperidin-1-yl)methyl]pyridine (PubChem CID 142137767) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine.

Molecular Properties

Compound Name4-[(4-ethenylpiperidin-1-yl)methyl]pyridine
PubChem CID142137767
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name4-[(4-ethenylpiperidin-1-yl)methyl]pyridine
SMILESC=CC1CCN(Cc2ccncc2)CC1
InChIInChI=1S/C13H18N2/c1-2-12-5-9-15(10-6-12)11-13-3-7-14-8-4-13/h2-4,7-8,12H,1,5-6,9-11H2
InChIKeyRTZHLUMNSQPJPL-UHFFFAOYSA-N
XLogP2.48
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-[[4-(chloromethyl)piperidin-1-yl]methyl]pyridine
CID 63387556
1-(pyridin-4-ylmethyl)-4-[[4-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]phenyl]methyl]piperazine
CID 132515507
(3S)-1-(pyridin-4-ylmethyl)pyrrolidin-3-amine
CID 39225703
1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]prop-2-en-1-one
CID 60953087
1-(cyclobutylmethyl)-4-(pyridin-4-ylmethyl)piperazine
CID 171130429
3-chloro-5-prop-2-enyl-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridin-2-amine
CID 141133485
1-(pyridin-4-ylmethyl)piperidin-4-one
CID 10997815
(3R,4R)-1-(pyridin-4-ylmethyl)pyrrolidine-3,4-diol
CID 143992061
4-[[4-(4-methylphenoxy)piperidin-1-yl]methyl]pyridine
CID 90245740
(3aR,7aS)-5-(pyridin-4-ylmethyl)-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridine
CID 125118012
1-(pyridin-3-ylmethyl)piperidine-4-carbaldehyde
CID 42556102
4-[(3-methylpiperidin-1-yl)methyl]pyridine
CID 121401070

Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine?
The IUPAC name of 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine (CID 142137767) is 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine.
What is the SMILES notation for 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine?
The canonical SMILES for 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine is C=CC1CCN(Cc2ccncc2)CC1.
What is the InChIKey of 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine?
The InChIKey is RTZHLUMNSQPJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-2-12-5-9-15(10-6-12)11-13-3-7-14-8-4-13/h2-4,7-8,12H,1,5-6,9-11H2.
What are the key properties of 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine?
4-[(4-ethenylpiperidin-1-yl)methyl]pyridine has a molecular weight of 202.30 g/mol, XLogP of 2.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethenylpiperidin-1-yl)methyl]pyridine is sourced from PubChem (CID 142137767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).