N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine

C9H16N2 — CID 143603218

IUPACN-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine
SMILESC/C=N/C1=C(C)CCNC1C
InChIInChI=1S/C9H16N2/c1-4-10-9-7(2)5-6-11-8(9)3/h4,8,11H,5-6H2,1-3H3/b10-4+
InChIKeyHYSDHCFJCCTEAB-ONNFQVAWSA-N
MW152.24 g/mol
LogP1.73
Rot. Bonds1

About N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine

N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine (PubChem CID 143603218) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine.

Molecular Properties

Compound NameN-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine
PubChem CID143603218
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC NameN-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine
SMILESC/C=N/C1=C(C)CCNC1C
InChIInChI=1S/C9H16N2/c1-4-10-9-7(2)5-6-11-8(9)3/h4,8,11H,5-6H2,1-3H3/b10-4+
InChIKeyHYSDHCFJCCTEAB-ONNFQVAWSA-N
XLogP1.73
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine?
The IUPAC name of N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine (CID 143603218) is N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine.
What is the SMILES notation for N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine?
The canonical SMILES for N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine is C/C=N/C1=C(C)CCNC1C.
What is the InChIKey of N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine?
The InChIKey is HYSDHCFJCCTEAB-ONNFQVAWSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-10-9-7(2)5-6-11-8(9)3/h4,8,11H,5-6H2,1-3H3/b10-4+.
What are the key properties of N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine?
N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine has a molecular weight of 152.24 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethyl-1,2,3,6-tetrahydropyridin-5-yl)ethanimine is sourced from PubChem (CID 143603218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).