ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine

C10H18N2 — CID 142384191

IUPACethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine
SMILESC=CC1=C(N=C)CCNC1.CC
InChIInChI=1S/C8H12N2.C2H6/c1-3-7-6-10-5-4-8(7)9-2;1-2/h3,10H,1-2,4-6H2;1-2H3
InChIKeyJSYHMIDEBMGQSQ-UHFFFAOYSA-N
MW166.27 g/mol
LogP2.15
Rot. Bonds2

About ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine

ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine (PubChem CID 142384191) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine.

Molecular Properties

Compound Nameethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine
PubChem CID142384191
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Nameethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine
SMILESC=CC1=C(N=C)CCNC1.CC
InChIInChI=1S/C8H12N2.C2H6/c1-3-7-6-10-5-4-8(7)9-2;1-2/h3,10H,1-2,4-6H2;1-2H3
InChIKeyJSYHMIDEBMGQSQ-UHFFFAOYSA-N
XLogP2.15
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(1E,3Z)-2-fluoro-1-(1,2,3,6-tetrahydropyridin-4-yl)penta-1,3-dienyl]methanimine
CID 130331428
5-[(Z)-3-aminoprop-1-enyl]-1-(2-fluoroethyl)-N-methyl-3,6-dihydro-2H-pyridin-4-amine
CID 145195918
2-methyl-2,5,6,7,8,9-hexahydro-1H-pyrido[2,3-d]azepine
CID 69188077
N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine
CID 70267946
N-(5-ethenyl-2,3-dihydro-1H-pyrrol-4-yl)methanimine
CID 70268048
5-[(1Z)-buta-1,3-dienyl]-1,2,3,6-tetrahydropyridin-4-amine
CID 88986515
4-methyl-6-[(2Z)-3-methylpenta-2,4-dienyl]-1,2-dihydropyridine
CID 89171173
(Z)-3-N-methyl-2-[(Z)-prop-1-enyl]pent-2-ene-1,3-diamine
CID 89185746
6-Ethyl-5-methyl-1,2-dihydropyridine
CID 90054873
(1Z,3Z)-1-(5-methyl-1,2-dihydropyridin-6-yl)hexa-1,3-dien-3-amine
CID 90231344
2-butan-2-ylidene-3-ethylidene-N-methylpyridin-4-amine
CID 91502715
N-[(1Z)-1-[(5Z)-5-ethylidene-1,2-dihydropyridin-6-ylidene]ethyl]butan-1-imine
CID 118124176

Frequently Asked Questions

What is the IUPAC name of ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine?
The IUPAC name of ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine (CID 142384191) is ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine.
What is the SMILES notation for ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine?
The canonical SMILES for ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine is C=CC1=C(N=C)CCNC1.CC.
What is the InChIKey of ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine?
The InChIKey is JSYHMIDEBMGQSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2.C2H6/c1-3-7-6-10-5-4-8(7)9-2;1-2/h3,10H,1-2,4-6H2;1-2H3.
What are the key properties of ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine?
ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine has a molecular weight of 166.27 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(5-ethenyl-1,2,3,6-tetrahydropyridin-4-yl)methanimine is sourced from PubChem (CID 142384191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).