3,6-dimethyl-2-methylidenepyridin-1-amine

C8H12N2 — CID 123167586

IUPAC3,6-dimethyl-2-methylidenepyridin-1-amine
SMILESC=C1C(C)=CC=C(C)N1N
InChIInChI=1S/C8H12N2/c1-6-4-5-7(2)10(9)8(6)3/h4-5H,3,9H2,1-2H3
InChIKeyUZKRRBPEDGHWJF-UHFFFAOYSA-N
MW136.20 g/mol
LogP1.54
Rot. Bonds

About 3,6-dimethyl-2-methylidenepyridin-1-amine

3,6-dimethyl-2-methylidenepyridin-1-amine (PubChem CID 123167586) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is 3,6-dimethyl-2-methylidenepyridin-1-amine.

Molecular Properties

Compound Name3,6-dimethyl-2-methylidenepyridin-1-amine
PubChem CID123167586
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name3,6-dimethyl-2-methylidenepyridin-1-amine
SMILESC=C1C(C)=CC=C(C)N1N
InChIInChI=1S/C8H12N2/c1-6-4-5-7(2)10(9)8(6)3/h4-5H,3,9H2,1-2H3
InChIKeyUZKRRBPEDGHWJF-UHFFFAOYSA-N
XLogP1.54
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-2-methylidenepyridin-1-amine?
The IUPAC name of 3,6-dimethyl-2-methylidenepyridin-1-amine (CID 123167586) is 3,6-dimethyl-2-methylidenepyridin-1-amine.
What is the SMILES notation for 3,6-dimethyl-2-methylidenepyridin-1-amine?
The canonical SMILES for 3,6-dimethyl-2-methylidenepyridin-1-amine is C=C1C(C)=CC=C(C)N1N.
What is the InChIKey of 3,6-dimethyl-2-methylidenepyridin-1-amine?
The InChIKey is UZKRRBPEDGHWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-6-4-5-7(2)10(9)8(6)3/h4-5H,3,9H2,1-2H3.
What are the key properties of 3,6-dimethyl-2-methylidenepyridin-1-amine?
3,6-dimethyl-2-methylidenepyridin-1-amine has a molecular weight of 136.20 g/mol, XLogP of 1.54, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-2-methylidenepyridin-1-amine is sourced from PubChem (CID 123167586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).