7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine

C18H19FN4 — CID 86342247

IUPAC7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine
SMILESCc1ccc(-c2cn3ccc(N4CCC(F)CC4)nc3n2)cc1
InChIInChI=1S/C18H19FN4/c1-13-2-4-14(5-3-13)16-12-23-11-8-17(21-18(23)20-16)22-9-6-15(19)7-10-22/h2-5,8,11-12,15H,6-7,9-10H2,1H3
InChIKeyIHNLUGKBEKCTFU-UHFFFAOYSA-N
MW310.38 g/mol
LogP3.64
Rot. Bonds2

About 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine

7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine (PubChem CID 86342247) has the molecular formula C18H19FN4 and a molecular weight of 310.38 g/mol. Its IUPAC name is 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine
PubChem CID86342247
Molecular FormulaC18H19FN4
Molecular Weight310.38 g/mol
Exact Mass310.16
IUPAC Name7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine
SMILESCc1ccc(-c2cn3ccc(N4CCC(F)CC4)nc3n2)cc1
InChIInChI=1S/C18H19FN4/c1-13-2-4-14(5-3-13)16-12-23-11-8-17(21-18(23)20-16)22-9-6-15(19)7-10-22/h2-5,8,11-12,15H,6-7,9-10H2,1H3
InChIKeyIHNLUGKBEKCTFU-UHFFFAOYSA-N
XLogP3.64
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine 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 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine (CID 86342247) is 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine is Cc1ccc(-c2cn3ccc(N4CCC(F)CC4)nc3n2)cc1.
What is the InChIKey of 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine?
The InChIKey is IHNLUGKBEKCTFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN4/c1-13-2-4-14(5-3-13)16-12-23-11-8-17(21-18(23)20-16)22-9-6-15(19)7-10-22/h2-5,8,11-12,15H,6-7,9-10H2,1H3.
What are the key properties of 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine?
7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine has a molecular weight of 310.38 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-fluoropiperidin-1-yl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 86342247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).