4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine

C12H18N4 — CID 118020749

IUPAC4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine
SMILESCCC1=CC(C2=CCN(N)C=C2)=CCN1N
InChIInChI=1S/C12H18N4/c1-2-12-9-11(5-8-16(12)14)10-3-6-15(13)7-4-10/h3-6,9H,2,7-8,13-14H2,1H3
InChIKeyGETSBOCYVXVMGE-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.03
Rot. Bonds2

About 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine

4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine (PubChem CID 118020749) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine.

Molecular Properties

Compound Name4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine
PubChem CID118020749
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine
SMILESCCC1=CC(C2=CCN(N)C=C2)=CCN1N
InChIInChI=1S/C12H18N4/c1-2-12-9-11(5-8-16(12)14)10-3-6-15(13)7-4-10/h3-6,9H,2,7-8,13-14H2,1H3
InChIKeyGETSBOCYVXVMGE-UHFFFAOYSA-N
XLogP1.03
TPSA58.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-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 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine?
The IUPAC name of 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine (CID 118020749) is 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine.
What is the SMILES notation for 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine?
The canonical SMILES for 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine is CCC1=CC(C2=CCN(N)C=C2)=CCN1N.
What is the InChIKey of 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine?
The InChIKey is GETSBOCYVXVMGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-2-12-9-11(5-8-16(12)14)10-3-6-15(13)7-4-10/h3-6,9H,2,7-8,13-14H2,1H3.
What are the key properties of 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine?
4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine has a molecular weight of 218.30 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-amino-2H-pyridin-4-yl)-6-ethyl-2H-pyridin-1-amine is sourced from PubChem (CID 118020749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).