2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine

C14H22N2 — CID 143976494

IUPAC2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine
SMILESC=C(C)CC1CC=CC(N2CCCCC2)=N1
InChIInChI=1S/C14H22N2/c1-12(2)11-13-7-6-8-14(15-13)16-9-4-3-5-10-16/h6,8,13H,1,3-5,7,9-11H2,2H3
InChIKeyZTAIBTZXLFOBDY-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.17
Rot. Bonds2

About 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine

2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine (PubChem CID 143976494) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine.

Molecular Properties

Compound Name2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine
PubChem CID143976494
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine
SMILESC=C(C)CC1CC=CC(N2CCCCC2)=N1
InChIInChI=1S/C14H22N2/c1-12(2)11-13-7-6-8-14(15-13)16-9-4-3-5-10-16/h6,8,13H,1,3-5,7,9-11H2,2H3
InChIKeyZTAIBTZXLFOBDY-UHFFFAOYSA-N
XLogP3.17
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.17
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

1-cyclohexyl-N-propan-2-yl-2,5-dihydropyridin-6-imine
CID 56607994
2-(Cyclohexen-1-yl)-3-methyl-3a,4,5,7a-tetrahydrobenzimidazole
CID 71018190
5-But-3-enyl-2-(cyclohexen-1-yl)-1,4-dimethyl-4,5-dihydroimidazole
CID 89192507
(3S)-1,3,4-trimethyl-5,6,7,8-tetrahydro-3H-pyrido[1,2-c]pyrimidine
CID 126756946
1,3,4-trimethyl-5,6,7,8-tetrahydro-3H-pyrido[1,2-c]pyrimidine
CID 126757105
(8E)-3-ethyl-8-ethylidene-3,5,6,7-tetrahydro-2H-imidazo[1,2-a]pyridine
CID 143988075
N-methyl-1-pentan-2-yl-2,3-dihydropyridin-6-imine
CID 146550503
N-cyclohex-2-en-1-yl-N,N'-dimethylethanimidamide
CID 163717043
2-Methyl-2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azonine
CID 166764270
(4aZ,6Z,8Z)-N,2-di(propan-2-yl)-3,4-dihydrocycloocta[c]pyridin-1-imine
CID 174047615
(4S,5R)-1-[(1R)-cyclohex-2-en-1-yl]-2,3,4,5-tetramethyl-4,5-dihydroimidazol-3-ium
CID 176815344
(4S)-1-[(1R)-cyclohex-2-en-1-yl]-2,3,4-trimethyl-4,5-dihydroimidazol-1-ium
CID 176815430

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine?
The IUPAC name of 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine (CID 143976494) is 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine.
What is the SMILES notation for 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine?
The canonical SMILES for 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine is C=C(C)CC1CC=CC(N2CCCCC2)=N1.
What is the InChIKey of 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine?
The InChIKey is ZTAIBTZXLFOBDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-12(2)11-13-7-6-8-14(15-13)16-9-4-3-5-10-16/h6,8,13H,1,3-5,7,9-11H2,2H3.
What are the key properties of 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine?
2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine has a molecular weight of 218.34 g/mol, XLogP of 3.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylprop-2-enyl)-6-piperidin-1-yl-2,3-dihydropyridine is sourced from PubChem (CID 143976494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).