N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine

C7H8FN5 — CID 131102033

IUPACN-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESFCCNc1ncnc2[nH]ncc12
InChIInChI=1S/C7H8FN5/c8-1-2-9-6-5-3-12-13-7(5)11-4-10-6/h3-4H,1-2H2,(H2,9,10,11,12,13)
InChIKeyMEKGBYSLPOBEFE-UHFFFAOYSA-N
MW181.17 g/mol
LogP0.73
Rot. Bonds3

About N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine

N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 131102033) has the molecular formula C7H8FN5 and a molecular weight of 181.17 g/mol. Its IUPAC name is N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID131102033
Molecular FormulaC7H8FN5
Molecular Weight181.17 g/mol
Exact Mass181.08
IUPAC NameN-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESFCCNc1ncnc2[nH]ncc12
InChIInChI=1S/C7H8FN5/c8-1-2-9-6-5-3-12-13-7(5)11-4-10-6/h3-4H,1-2H2,(H2,9,10,11,12,13)
InChIKeyMEKGBYSLPOBEFE-UHFFFAOYSA-N
XLogP0.73
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.17
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]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-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine (CID 131102033) is N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine is FCCNc1ncnc2[nH]ncc12.
What is the InChIKey of N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is MEKGBYSLPOBEFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FN5/c8-1-2-9-6-5-3-12-13-7(5)11-4-10-6/h3-4H,1-2H2,(H2,9,10,11,12,13).
What are the key properties of N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 181.17 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 131102033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).