2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine

C7H10FN5 — CID 141397196

IUPAC2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine
SMILESNc1nc(NC2CC2)nc(N)c1F
InChIInChI=1S/C7H10FN5/c8-4-5(9)12-7(13-6(4)10)11-3-1-2-3/h3H,1-2H2,(H5,9,10,11,12,13)
InChIKeyLHQRLNSQGGPLCJ-UHFFFAOYSA-N
MW183.19 g/mol
LogP0.35
Rot. Bonds2

About 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine

2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine (PubChem CID 141397196) has the molecular formula C7H10FN5 and a molecular weight of 183.19 g/mol. Its IUPAC name is 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine.

Molecular Properties

Compound Name2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine
PubChem CID141397196
Molecular FormulaC7H10FN5
Molecular Weight183.19 g/mol
Exact Mass183.09
IUPAC Name2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine
SMILESNc1nc(NC2CC2)nc(N)c1F
InChIInChI=1S/C7H10FN5/c8-4-5(9)12-7(13-6(4)10)11-3-1-2-3/h3H,1-2H2,(H5,9,10,11,12,13)
InChIKeyLHQRLNSQGGPLCJ-UHFFFAOYSA-N
XLogP0.35
TPSA89.85 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.19
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine 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-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine?
The IUPAC name of 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine (CID 141397196) is 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine.
What is the SMILES notation for 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine?
The canonical SMILES for 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine is Nc1nc(NC2CC2)nc(N)c1F.
What is the InChIKey of 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine?
The InChIKey is LHQRLNSQGGPLCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN5/c8-4-5(9)12-7(13-6(4)10)11-3-1-2-3/h3H,1-2H2,(H5,9,10,11,12,13).
What are the key properties of 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine?
2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine has a molecular weight of 183.19 g/mol, XLogP of 0.35, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-5-fluoropyrimidine-2,4,6-triamine is sourced from PubChem (CID 141397196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).