2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine

C13H24N2 — CID 54237489

IUPAC2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine
SMILESCC(C)/C=N/C1=CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C13H24N2/c1-10(2)9-14-11-7-12(3,4)15-13(5,6)8-11/h7,9-10,15H,8H2,1-6H3/b14-9+
InChIKeyQNPCDYPFUHBFDK-NTEUORMPSA-N
MW208.35 g/mol
LogP3.15
Rot. Bonds2

About 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine

2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine (PubChem CID 54237489) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine.

Molecular Properties

Compound Name2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine
PubChem CID54237489
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine
SMILESCC(C)/C=N/C1=CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C13H24N2/c1-10(2)9-14-11-7-12(3,4)15-13(5,6)8-11/h7,9-10,15H,8H2,1-6H3/b14-9+
InChIKeyQNPCDYPFUHBFDK-NTEUORMPSA-N
XLogP3.15
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 53.15
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-t-butyl-N-(2,2-dimethyl-1,2,3,4-tetrahydropyridin-4-ylidene)ammonium iodide
CID 129841887
N-methyl-2-(3-methyl-3,4-dihydropyridin-6-yl)ethanamine
CID 91433495
3-Methyl-6-methylidene-5-propan-2-ylpyridin-3-amine
CID 129200499
1-(3,4-dihydropyridin-6-yl)-N,2-dimethylpropan-2-amine
CID 143751746
N-tert-butyl-4-methyl-3,4-dihydropyridin-5-amine
CID 166650122
N-tert-butyl-5-(2-methylpropylimino)pent-2-en-2-amine
CID 173006689
N-tert-butyl-2,2-dimethyl-3H-pyridin-4-amine
CID 129841888

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine?
The IUPAC name of 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine (CID 54237489) is 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine.
What is the SMILES notation for 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine?
The canonical SMILES for 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine is CC(C)/C=N/C1=CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine?
The InChIKey is QNPCDYPFUHBFDK-NTEUORMPSA-N. The full InChI is InChI=1S/C13H24N2/c1-10(2)9-14-11-7-12(3,4)15-13(5,6)8-11/h7,9-10,15H,8H2,1-6H3/b14-9+.
What are the key properties of 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine?
2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine has a molecular weight of 208.35 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2,2,6,6-tetramethyl-1,3-dihydropyridin-4-yl)propan-1-imine is sourced from PubChem (CID 54237489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).