5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile

C10H11FN4 — CID 169090103

IUPAC5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile
SMILESN#Cc1nc(N2CCCCC2)ncc1F
InChIInChI=1S/C10H11FN4/c11-8-7-13-10(14-9(8)6-12)15-4-2-1-3-5-15/h7H,1-5H2
InChIKeyZBEVIELVGVQGII-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.48
Rot. Bonds1

About 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile

5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile (PubChem CID 169090103) has the molecular formula C10H11FN4 and a molecular weight of 206.22 g/mol. Its IUPAC name is 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile.

Molecular Properties

Compound Name5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile
PubChem CID169090103
Molecular FormulaC10H11FN4
Molecular Weight206.22 g/mol
Exact Mass206.10
IUPAC Name5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile
SMILESN#Cc1nc(N2CCCCC2)ncc1F
InChIInChI=1S/C10H11FN4/c11-8-7-13-10(14-9(8)6-12)15-4-2-1-3-5-15/h7H,1-5H2
InChIKeyZBEVIELVGVQGII-UHFFFAOYSA-N
XLogP1.48
TPSA52.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile 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-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile?
The IUPAC name of 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile (CID 169090103) is 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile.
What is the SMILES notation for 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile?
The canonical SMILES for 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile is N#Cc1nc(N2CCCCC2)ncc1F.
What is the InChIKey of 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile?
The InChIKey is ZBEVIELVGVQGII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN4/c11-8-7-13-10(14-9(8)6-12)15-4-2-1-3-5-15/h7H,1-5H2.
What are the key properties of 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile?
5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile has a molecular weight of 206.22 g/mol, XLogP of 1.48, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-piperidin-1-ylpyrimidine-4-carbonitrile is sourced from PubChem (CID 169090103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).