5-methyl-3,4-dihydro-2H-pyridin-5-amine

C6H12N2 — CID 123308056

IUPAC5-methyl-3,4-dihydro-2H-pyridin-5-amine
SMILESCC1(N)C=NCCC1
InChIInChI=1S/C6H12N2/c1-6(7)3-2-4-8-5-6/h5H,2-4,7H2,1H3
InChIKeySRMBJAIIYCCUTG-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.57
Rot. Bonds

About 5-methyl-3,4-dihydro-2H-pyridin-5-amine

5-methyl-3,4-dihydro-2H-pyridin-5-amine (PubChem CID 123308056) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 5-methyl-3,4-dihydro-2H-pyridin-5-amine.

Molecular Properties

Compound Name5-methyl-3,4-dihydro-2H-pyridin-5-amine
PubChem CID123308056
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name5-methyl-3,4-dihydro-2H-pyridin-5-amine
SMILESCC1(N)C=NCCC1
InChIInChI=1S/C6H12N2/c1-6(7)3-2-4-8-5-6/h5H,2-4,7H2,1H3
InChIKeySRMBJAIIYCCUTG-UHFFFAOYSA-N
XLogP0.57
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 ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-methyl-3,4-dihydro-2H-pyridin-5-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 5-methyl-3,4-dihydro-2H-pyridin-5-amine?
The IUPAC name of 5-methyl-3,4-dihydro-2H-pyridin-5-amine (CID 123308056) is 5-methyl-3,4-dihydro-2H-pyridin-5-amine.
What is the SMILES notation for 5-methyl-3,4-dihydro-2H-pyridin-5-amine?
The canonical SMILES for 5-methyl-3,4-dihydro-2H-pyridin-5-amine is CC1(N)C=NCCC1.
What is the InChIKey of 5-methyl-3,4-dihydro-2H-pyridin-5-amine?
The InChIKey is SRMBJAIIYCCUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-6(7)3-2-4-8-5-6/h5H,2-4,7H2,1H3.
What are the key properties of 5-methyl-3,4-dihydro-2H-pyridin-5-amine?
5-methyl-3,4-dihydro-2H-pyridin-5-amine has a molecular weight of 112.18 g/mol, XLogP of 0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3,4-dihydro-2H-pyridin-5-amine is sourced from PubChem (CID 123308056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).