1,5-dimethyl-2,5-dihydropyridin-6-imine

C7H12N2 — CID 56607400

IUPAC1,5-dimethyl-2,5-dihydropyridin-6-imine
SMILES[H]/N=C1\C(C)C=CCN1C
InChIInChI=1S/C7H12N2/c1-6-4-3-5-9(2)7(6)8/h3-4,6,8H,5H2,1-2H3/b8-7+
InChIKeyZLQRQHKBKTWRSF-BQYQJAHWSA-N
MW124.19 g/mol
LogP1.10
Rot. Bonds

About 1,5-dimethyl-2,5-dihydropyridin-6-imine

1,5-dimethyl-2,5-dihydropyridin-6-imine (PubChem CID 56607400) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 1,5-dimethyl-2,5-dihydropyridin-6-imine.

Molecular Properties

Compound Name1,5-dimethyl-2,5-dihydropyridin-6-imine
PubChem CID56607400
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name1,5-dimethyl-2,5-dihydropyridin-6-imine
SMILES[H]/N=C1\C(C)C=CCN1C
InChIInChI=1S/C7H12N2/c1-6-4-3-5-9(2)7(6)8/h3-4,6,8H,5H2,1-2H3/b8-7+
InChIKeyZLQRQHKBKTWRSF-BQYQJAHWSA-N
XLogP1.10
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Methyl-2,3-dihydropyridin-6-imine
CID 20315456
1-Methyl-2,5-dihydropyridin-6-imine
CID 56616795
N,1-dimethyl-2,5-dihydropyridin-6-imine
CID 56620788
(1-Methyl-2,5-dihydropyridin-6-ylidene)hydrazine
CID 56628764
5-Methyl-1-(2-methylpropanimidoyl)pyridin-2-imine
CID 91128581
1-Chloro-2,5-dihydropyridin-6-imine
CID 91526954
1-(3,6-dihydro-2H-pyridin-1-yl)ethanimine
CID 152747753
N-[(Z)-hex-2-enyl]-N,2-dimethylpropanimidamide
CID 174183986

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-2,5-dihydropyridin-6-imine?
The IUPAC name of 1,5-dimethyl-2,5-dihydropyridin-6-imine (CID 56607400) is 1,5-dimethyl-2,5-dihydropyridin-6-imine.
What is the SMILES notation for 1,5-dimethyl-2,5-dihydropyridin-6-imine?
The canonical SMILES for 1,5-dimethyl-2,5-dihydropyridin-6-imine is [H]/N=C1\C(C)C=CCN1C.
What is the InChIKey of 1,5-dimethyl-2,5-dihydropyridin-6-imine?
The InChIKey is ZLQRQHKBKTWRSF-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H12N2/c1-6-4-3-5-9(2)7(6)8/h3-4,6,8H,5H2,1-2H3/b8-7+.
What are the key properties of 1,5-dimethyl-2,5-dihydropyridin-6-imine?
1,5-dimethyl-2,5-dihydropyridin-6-imine has a molecular weight of 124.19 g/mol, XLogP of 1.10, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-2,5-dihydropyridin-6-imine is sourced from PubChem (CID 56607400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).