5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine

C7H12N2 — CID 123202372

IUPAC5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine
SMILES[H]/N=C1\CCN=C(C)C1C
InChIInChI=1S/C7H12N2/c1-5-6(2)9-4-3-7(5)8/h5,8H,3-4H2,1-2H3/b8-7+
InChIKeySEKTYIBLUZGZPB-BQYQJAHWSA-N
MW124.19 g/mol
LogP1.51
Rot. Bonds

About 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine

5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine (PubChem CID 123202372) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine.

Molecular Properties

Compound Name5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine
PubChem CID123202372
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine
SMILES[H]/N=C1\CCN=C(C)C1C
InChIInChI=1S/C7H12N2/c1-5-6(2)9-4-3-7(5)8/h5,8H,3-4H2,1-2H3/b8-7+
InChIKeySEKTYIBLUZGZPB-BQYQJAHWSA-N
XLogP1.51
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.51
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 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine?
The IUPAC name of 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine (CID 123202372) is 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine.
What is the SMILES notation for 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine?
The canonical SMILES for 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine is [H]/N=C1\CCN=C(C)C1C.
What is the InChIKey of 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine?
The InChIKey is SEKTYIBLUZGZPB-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H12N2/c1-5-6(2)9-4-3-7(5)8/h5,8H,3-4H2,1-2H3/b8-7+.
What are the key properties of 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine?
5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine has a molecular weight of 124.19 g/mol, XLogP of 1.51, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-3,5-dihydro-2H-pyridin-4-imine is sourced from PubChem (CID 123202372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).