2-methyl-2,3,4,5-tetrahydropyridin-6-amine

C6H12N2 — CID 12778908

IUPAC2-methyl-2,3,4,5-tetrahydropyridin-6-amine
SMILESCC1CCCC(N)=N1
InChIInChI=1S/C6H12N2/c1-5-3-2-4-6(7)8-5/h5H,2-4H2,1H3,(H2,7,8)
InChIKeyUTJJCBMDCZDYKT-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.92
Rot. Bonds

About 2-methyl-2,3,4,5-tetrahydropyridin-6-amine

2-methyl-2,3,4,5-tetrahydropyridin-6-amine (PubChem CID 12778908) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 2-methyl-2,3,4,5-tetrahydropyridin-6-amine.

Molecular Properties

Compound Name2-methyl-2,3,4,5-tetrahydropyridin-6-amine
PubChem CID12778908
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name2-methyl-2,3,4,5-tetrahydropyridin-6-amine
SMILESCC1CCCC(N)=N1
InChIInChI=1S/C6H12N2/c1-5-3-2-4-6(7)8-5/h5H,2-4H2,1H3,(H2,7,8)
InChIKeyUTJJCBMDCZDYKT-UHFFFAOYSA-N
XLogP0.92
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-2,3,4,5-tetrahydropyridin-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,3,4,5-tetrahydropyridin-6-amine?
The IUPAC name of 2-methyl-2,3,4,5-tetrahydropyridin-6-amine (CID 12778908) is 2-methyl-2,3,4,5-tetrahydropyridin-6-amine.
What is the SMILES notation for 2-methyl-2,3,4,5-tetrahydropyridin-6-amine?
The canonical SMILES for 2-methyl-2,3,4,5-tetrahydropyridin-6-amine is CC1CCCC(N)=N1.
What is the InChIKey of 2-methyl-2,3,4,5-tetrahydropyridin-6-amine?
The InChIKey is UTJJCBMDCZDYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-5-3-2-4-6(7)8-5/h5H,2-4H2,1H3,(H2,7,8).
What are the key properties of 2-methyl-2,3,4,5-tetrahydropyridin-6-amine?
2-methyl-2,3,4,5-tetrahydropyridin-6-amine has a molecular weight of 112.18 g/mol, XLogP of 0.92, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,3,4,5-tetrahydropyridin-6-amine is sourced from PubChem (CID 12778908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).