1-methyl-3-methylidene-2H-pyridin-4-imine

C7H10N2 — CID 143618829

IUPAC1-methyl-3-methylidene-2H-pyridin-4-imine
SMILES[H]/N=C1\C=CN(C)CC1=C
InChIInChI=1S/C7H10N2/c1-6-5-9(2)4-3-7(6)8/h3-4,8H,1,5H2,2H3/b8-7+
InChIKeyKPWUTOUFHKTAGN-BQYQJAHWSA-N
MW122.17 g/mol
LogP1.02
Rot. Bonds

About 1-methyl-3-methylidene-2H-pyridin-4-imine

1-methyl-3-methylidene-2H-pyridin-4-imine (PubChem CID 143618829) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 1-methyl-3-methylidene-2H-pyridin-4-imine.

Molecular Properties

Compound Name1-methyl-3-methylidene-2H-pyridin-4-imine
PubChem CID143618829
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name1-methyl-3-methylidene-2H-pyridin-4-imine
SMILES[H]/N=C1\C=CN(C)CC1=C
InChIInChI=1S/C7H10N2/c1-6-5-9(2)4-3-7(6)8/h3-4,8H,1,5H2,2H3/b8-7+
InChIKeyKPWUTOUFHKTAGN-BQYQJAHWSA-N
XLogP1.02
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.02
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-Dimethyl-2,4-dihydropyridin-3-imine
CID 56618651
1-Methyl-2,3-dihydropyridin-4-imine
CID 57023527
1-Ethyl-2,4-dihydropyridin-3-imine
CID 57189564
1-Methyl-2,4-dihydropyridin-3-imine
CID 57245082
4-Methylidene-1,2-dihydropyridin-3-imine
CID 155474412
1-(1-methyl-2H-azet-2-yl)ethanimine
CID 164174206

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-methylidene-2H-pyridin-4-imine?
The IUPAC name of 1-methyl-3-methylidene-2H-pyridin-4-imine (CID 143618829) is 1-methyl-3-methylidene-2H-pyridin-4-imine.
What is the SMILES notation for 1-methyl-3-methylidene-2H-pyridin-4-imine?
The canonical SMILES for 1-methyl-3-methylidene-2H-pyridin-4-imine is [H]/N=C1\C=CN(C)CC1=C.
What is the InChIKey of 1-methyl-3-methylidene-2H-pyridin-4-imine?
The InChIKey is KPWUTOUFHKTAGN-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H10N2/c1-6-5-9(2)4-3-7(6)8/h3-4,8H,1,5H2,2H3/b8-7+.
What are the key properties of 1-methyl-3-methylidene-2H-pyridin-4-imine?
1-methyl-3-methylidene-2H-pyridin-4-imine has a molecular weight of 122.17 g/mol, XLogP of 1.02, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-methylidene-2H-pyridin-4-imine is sourced from PubChem (CID 143618829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).