N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine

C9H10N6 — CID 155941701

IUPACN-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
SMILESc1nc(NC2CC2)cc(-n2cncn2)n1
InChIInChI=1S/C9H10N6/c1-2-7(1)14-8-3-9(12-5-11-8)15-6-10-4-13-15/h3-7H,1-2H2,(H,11,12,14)
InChIKeyJPSUZWCRGOCNQG-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.63
Rot. Bonds3

About N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine

N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine (PubChem CID 155941701) has the molecular formula C9H10N6 and a molecular weight of 202.22 g/mol. Its IUPAC name is N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
PubChem CID155941701
Molecular FormulaC9H10N6
Molecular Weight202.22 g/mol
Exact Mass202.10
IUPAC NameN-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
SMILESc1nc(NC2CC2)cc(-n2cncn2)n1
InChIInChI=1S/C9H10N6/c1-2-7(1)14-8-3-9(12-5-11-8)15-6-10-4-13-15/h3-7H,1-2H2,(H,11,12,14)
InChIKeyJPSUZWCRGOCNQG-UHFFFAOYSA-N
XLogP0.63
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-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 N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine?
The IUPAC name of N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine (CID 155941701) is N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine.
What is the SMILES notation for N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine?
The canonical SMILES for N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine is c1nc(NC2CC2)cc(-n2cncn2)n1.
What is the InChIKey of N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine?
The InChIKey is JPSUZWCRGOCNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6/c1-2-7(1)14-8-3-9(12-5-11-8)15-6-10-4-13-15/h3-7H,1-2H2,(H,11,12,14).
What are the key properties of N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine?
N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine has a molecular weight of 202.22 g/mol, XLogP of 0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 155941701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).