1-ethyl-5-methyl-2,4-dihydropyridin-3-imine

C8H14N2 — CID 57064772

IUPAC1-ethyl-5-methyl-2,4-dihydropyridin-3-imine
SMILES[H]/N=C1\CC(C)=CN(CC)C1
InChIInChI=1S/C8H14N2/c1-3-10-5-7(2)4-8(9)6-10/h5,9H,3-4,6H2,1-2H3/b9-8+
InChIKeyRPPYSENNPZFMCW-CMDGGOBGSA-N
MW138.21 g/mol
LogP1.64
Rot. Bonds1

About 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine

1-ethyl-5-methyl-2,4-dihydropyridin-3-imine (PubChem CID 57064772) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine.

Molecular Properties

Compound Name1-ethyl-5-methyl-2,4-dihydropyridin-3-imine
PubChem CID57064772
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name1-ethyl-5-methyl-2,4-dihydropyridin-3-imine
SMILES[H]/N=C1\CC(C)=CN(CC)C1
InChIInChI=1S/C8H14N2/c1-3-10-5-7(2)4-8(9)6-10/h5,9H,3-4,6H2,1-2H3/b9-8+
InChIKeyRPPYSENNPZFMCW-CMDGGOBGSA-N
XLogP1.64
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.64
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

1,5-Diethyl-2-fluoro-2,4-dihydropyridin-3-imine
CID 57322744
(1,5-Dimethyl-2,4-dihydropyridin-3-ylidene)hydrazine
CID 56612588
N-ethyl-1,5-dimethyl-2,4-dihydropyridin-3-imine
CID 56613844
1,5-dimethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 56614183
5-Methyl-1-(2-methylpropyl)-2,4-dihydropyridin-3-imine
CID 56616930
1,5-diethyl-N-methyl-2,4-dihydropyridin-3-imine
CID 56617025
1,5-Dimethyl-2,4-dihydropyridin-3-imine
CID 56618651
2-[(1,5-dimethyl-2,4-dihydropyridin-3-ylidene)amino]-N,N-dimethylethanamine
CID 56621105
2-Butyl-1,5-dimethyl-2,4-dihydropyridin-3-imine
CID 56626073
N,N-diethyl-3-(3-imino-1,5-dimethyl-2,4-dihydropyridin-2-yl)propan-1-amine
CID 56633612
1,5-Diethyl-2,4-dihydropyridin-3-imine
CID 56635574
1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine
CID 56636914

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine?
The IUPAC name of 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine (CID 57064772) is 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine.
What is the SMILES notation for 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine?
The canonical SMILES for 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine is [H]/N=C1\CC(C)=CN(CC)C1.
What is the InChIKey of 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine?
The InChIKey is RPPYSENNPZFMCW-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H14N2/c1-3-10-5-7(2)4-8(9)6-10/h5,9H,3-4,6H2,1-2H3/b9-8+.
What are the key properties of 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine?
1-ethyl-5-methyl-2,4-dihydropyridin-3-imine has a molecular weight of 138.21 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-methyl-2,4-dihydropyridin-3-imine is sourced from PubChem (CID 57064772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).