N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine

C11H16N2 — CID 123272238

IUPACN-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine
SMILESC=CN1CC=C(/N=C/C)C(C)=C1C
InChIInChI=1S/C11H16N2/c1-5-12-11-7-8-13(6-2)10(4)9(11)3/h5-7H,2,8H2,1,3-4H3/b12-5+
InChIKeyUNGVIQJVIDKOPW-LFYBBSHMSA-N
MW176.26 g/mol
LogP2.71
Rot. Bonds2

About N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine

N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine (PubChem CID 123272238) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine.

Molecular Properties

Compound NameN-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine
PubChem CID123272238
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC NameN-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine
SMILESC=CN1CC=C(/N=C/C)C(C)=C1C
InChIInChI=1S/C11H16N2/c1-5-12-11-7-8-13(6-2)10(4)9(11)3/h5-7H,2,8H2,1,3-4H3/b12-5+
InChIKeyUNGVIQJVIDKOPW-LFYBBSHMSA-N
XLogP2.71
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Pyrazino[1,2-b]isoquinoline
CID 118184971
8-Dimethylamino-5-methyl-3,5,7-nonatrienylidenedimethylammonium iodide
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[(2E,4Z,6E,8E)-9-(dimethylamino)-5-[2-(dimethylamino)prop-1-enyl]nona-2,4,6,8-tetraenylidene]-dimethylazanium
CID 59109574
1-[(1-but-1-en-2-yl-3,6-dihydro-2H-pyridin-4-yl)methyl]-4H-pyridin-1-ium-4-ide;yttrium
CID 59188823
[9-(Dimethylamino)-5-[2-(dimethylamino)prop-1-enyl]nona-2,4,6,8-tetraenylidene]-dimethylazanium
CID 72519405
7-methyl-6H-1,7-naphthyridine
CID 85972581
(2E)-N-methyl-2-(3-methylidene-2-pyridinylidene)ethanimine
CID 88271063
(2Z,4E,6Z)-N-methyl-6-(2-methylidene-3-pyridinylidene)hexa-2,4-dien-1-imine
CID 89112517
(2Z,4E)-5-(1,2-dimethyl-2-pyridinyl)-N-methylhexa-2,4-dien-1-imine
CID 90152403
N-methyl-2-(2-methyl-1-propan-2-yl-2H-pyrrol-3-ylidene)ethanimine
CID 91253432
N-[(E)-(6-methyl-3-methylidene-2-pyridinylidene)methyl]ethanimine
CID 117635475
[(4Z,7Z)-9-(diethylamino)-5-[(E)-hex-2-en-2-yl]deca-4,7,9-trienylidene]-diethylazanium
CID 118120033

Frequently Asked Questions

What is the IUPAC name of N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine?
The IUPAC name of N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine (CID 123272238) is N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine.
What is the SMILES notation for N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine?
The canonical SMILES for N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine is C=CN1CC=C(/N=C/C)C(C)=C1C.
What is the InChIKey of N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine?
The InChIKey is UNGVIQJVIDKOPW-LFYBBSHMSA-N. The full InChI is InChI=1S/C11H16N2/c1-5-12-11-7-8-13(6-2)10(4)9(11)3/h5-7H,2,8H2,1,3-4H3/b12-5+.
What are the key properties of N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine?
N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine has a molecular weight of 176.26 g/mol, XLogP of 2.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethenyl-5,6-dimethyl-2H-pyridin-4-yl)ethanimine is sourced from PubChem (CID 123272238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).