3-methylidene-2H-pyridin-2-amine

C6H8N2 — CID 68545375

IUPAC3-methylidene-2H-pyridin-2-amine
SMILESC=C1C=CC=NC1N
InChIInChI=1S/C6H8N2/c1-5-3-2-4-8-6(5)7/h2-4,6H,1,7H2
InChIKeyVPRJYTMEJBMRBQ-UHFFFAOYSA-N
MW108.14 g/mol
LogP0.47
Rot. Bonds

About 3-methylidene-2H-pyridin-2-amine

3-methylidene-2H-pyridin-2-amine (PubChem CID 68545375) has the molecular formula C6H8N2 and a molecular weight of 108.14 g/mol. Its IUPAC name is 3-methylidene-2H-pyridin-2-amine.

Molecular Properties

Compound Name3-methylidene-2H-pyridin-2-amine
PubChem CID68545375
Molecular FormulaC6H8N2
Molecular Weight108.14 g/mol
Exact Mass108.07
IUPAC Name3-methylidene-2H-pyridin-2-amine
SMILESC=C1C=CC=NC1N
InChIInChI=1S/C6H8N2/c1-5-3-2-4-8-6(5)7/h2-4,6H,1,7H2
InChIKeyVPRJYTMEJBMRBQ-UHFFFAOYSA-N
XLogP0.47
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.14
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methylidene-2H-pyridin-2-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 3-methylidene-2H-pyridin-2-amine?
The IUPAC name of 3-methylidene-2H-pyridin-2-amine (CID 68545375) is 3-methylidene-2H-pyridin-2-amine.
What is the SMILES notation for 3-methylidene-2H-pyridin-2-amine?
The canonical SMILES for 3-methylidene-2H-pyridin-2-amine is C=C1C=CC=NC1N.
What is the InChIKey of 3-methylidene-2H-pyridin-2-amine?
The InChIKey is VPRJYTMEJBMRBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2/c1-5-3-2-4-8-6(5)7/h2-4,6H,1,7H2.
What are the key properties of 3-methylidene-2H-pyridin-2-amine?
3-methylidene-2H-pyridin-2-amine has a molecular weight of 108.14 g/mol, XLogP of 0.47, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-2H-pyridin-2-amine is sourced from PubChem (CID 68545375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).