N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine

C10H16N2 — CID 145259418

IUPACN-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine
SMILESCC/N=C(\C)C1=C(C)CCC=N1
InChIInChI=1S/C10H16N2/c1-4-11-9(3)10-8(2)6-5-7-12-10/h7H,4-6H2,1-3H3/b11-9+
InChIKeySGQCKZVWTKLYQT-PKNBQFBNSA-N
MW164.25 g/mol
LogP2.61
Rot. Bonds2

About N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine

N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine (PubChem CID 145259418) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine.

Molecular Properties

Compound NameN-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine
PubChem CID145259418
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC NameN-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine
SMILESCC/N=C(\C)C1=C(C)CCC=N1
InChIInChI=1S/C10H16N2/c1-4-11-9(3)10-8(2)6-5-7-12-10/h7H,4-6H2,1-3H3/b11-9+
InChIKeySGQCKZVWTKLYQT-PKNBQFBNSA-N
XLogP2.61
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.61
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

1-N,4-N,2,3,5,6-hexamethylcyclohexa-2,5-diene-1,4-diimine
CID 18739815
5,6-Dimethyl-3,4-dihydropyridine
CID 68338056
2,3-dimethyl-5-methylidene-4H-pyridine
CID 89005507
(1Z)-1-(5-methylimino-2,3-dihydropyridin-4-ylidene)ethanamine
CID 89510152
4-(C,N-dimethylcarbonimidoyl)-2,3-dihydropyridin-5-amine
CID 89510154
1-(5-methyl-3,4-dihydropyridin-6-yl)-N-prop-1-en-2-ylmethanimine
CID 89748394
(3E,6E)-2-N,8-N,3,4,6,7-hexamethylnona-3,6-diene-2,8-diimine
CID 89900803
3-(C,N-dimethylcarbonimidoyl)oct-2-en-2-yl-ethylidene-methylazanium
CID 91207346
3,4,7,8-Tetrahydro-1,6-naphthyridine
CID 91353807
5-Methyl-6-propan-2-yl-3,4-dihydropyridine
CID 91423818
5-Butan-2-yl-4-methyl-2-propan-2-ylidenepyrimidin-3-ide
CID 91446216
2,3-dimethyl-5-methylidene-4H-pyridine;ethane
CID 91581302

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine?
The IUPAC name of N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine (CID 145259418) is N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine.
What is the SMILES notation for N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine?
The canonical SMILES for N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine is CC/N=C(\C)C1=C(C)CCC=N1.
What is the InChIKey of N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine?
The InChIKey is SGQCKZVWTKLYQT-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H16N2/c1-4-11-9(3)10-8(2)6-5-7-12-10/h7H,4-6H2,1-3H3/b11-9+.
What are the key properties of N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine?
N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine has a molecular weight of 164.25 g/mol, XLogP of 2.61, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-methyl-3,4-dihydropyridin-6-yl)ethanimine is sourced from PubChem (CID 145259418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).