4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine

C12H16N2 — CID 144911658

IUPAC4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine
SMILESC=CN1CC=C(C2=CC=NCC2)CC1
InChIInChI=1S/C12H16N2/c1-2-14-9-5-12(6-10-14)11-3-7-13-8-4-11/h2-3,5,7H,1,4,6,8-10H2
InChIKeyFPJGXEOHRDFGKR-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.16
Rot. Bonds2

About 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine

4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine (PubChem CID 144911658) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine.

Molecular Properties

Compound Name4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine
PubChem CID144911658
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine
SMILESC=CN1CC=C(C2=CC=NCC2)CC1
InChIInChI=1S/C12H16N2/c1-2-14-9-5-12(6-10-14)11-3-7-13-8-4-11/h2-3,5,7H,1,4,6,8-10H2
InChIKeyFPJGXEOHRDFGKR-UHFFFAOYSA-N
XLogP2.16
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 57055610
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CID 57148887
1-[(1-but-1-en-2-yl-3,6-dihydro-2H-pyridin-4-yl)methyl]-4H-pyridin-1-ium-4-ide;yttrium
CID 59188823
5,9-Diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1,4,6,10,13(17),14-hexaene
CID 91529404
7,11-Diazatricyclo[7.3.1.02,7]trideca-1(12),2,4,8,10-pentaene
CID 91537534
5-(piperidin-1-ylmethyl)-4H-azepine
CID 123405058
(1E,3E)-8-[(2E)-1-ethyl-3-methylidene-2-prop-2-enylidenepyridin-1-ium-4-yl]-N,N-dimethylocta-1,3,5,7-tetraen-1-amine
CID 136621642
(2Z)-4-methyl-1-methylidene-2-(4-methyl-1-methylidene-2,5-dihydropyridin-1-ium-2,5-diid-6-ylidene)pyridin-1-ium
CID 140446381
(2Z,4Z)-2-(2,3-dihydropyridin-3-yl)-N,N-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine
CID 143295886
(E)-N-ethenyl-3-[(3E)-1-ethyl-4-methylidene-3-prop-2-enylidenepiperidin-2-yl]prop-2-en-1-imine
CID 143866486
ethane;4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine
CID 144911657
N-[(1Z)-3-(2,3-dihydropyridin-4-yl)buta-1,3-dienyl]methanimine
CID 145263414

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine?
The IUPAC name of 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine (CID 144911658) is 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine.
What is the SMILES notation for 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine?
The canonical SMILES for 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine is C=CN1CC=C(C2=CC=NCC2)CC1.
What is the InChIKey of 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine?
The InChIKey is FPJGXEOHRDFGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-2-14-9-5-12(6-10-14)11-3-7-13-8-4-11/h2-3,5,7H,1,4,6,8-10H2.
What are the key properties of 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine?
4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine has a molecular weight of 188.27 g/mol, XLogP of 2.16, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethenyl-3,6-dihydro-2H-pyridin-4-yl)-2,3-dihydropyridine is sourced from PubChem (CID 144911658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).