3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine

C16H17N5O — CID 44586278

IUPAC3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine
SMILESc1ccn2c(-c3ccnc(OC4CCNCC4)n3)cnc2c1
InChIInChI=1S/C16H17N5O/c1-2-10-21-14(11-19-15(21)3-1)13-6-9-18-16(20-13)22-12-4-7-17-8-5-12/h1-3,6,9-12,17H,4-5,7-8H2
InChIKeyLRUYYHYHACYRQS-UHFFFAOYSA-N
MW295.35 g/mol
LogP1.92
Rot. Bonds3

About 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine

3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine (PubChem CID 44586278) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine
PubChem CID44586278
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Name3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine
SMILESc1ccn2c(-c3ccnc(OC4CCNCC4)n3)cnc2c1
InChIInChI=1S/C16H17N5O/c1-2-10-21-14(11-19-15(21)3-1)13-6-9-18-16(20-13)22-12-4-7-17-8-5-12/h1-3,6,9-12,17H,4-5,7-8H2
InChIKeyLRUYYHYHACYRQS-UHFFFAOYSA-N
XLogP1.92
TPSA64.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine (CID 44586278) is 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine is c1ccn2c(-c3ccnc(OC4CCNCC4)n3)cnc2c1.
What is the InChIKey of 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine?
The InChIKey is LRUYYHYHACYRQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-2-10-21-14(11-19-15(21)3-1)13-6-9-18-16(20-13)22-12-4-7-17-8-5-12/h1-3,6,9-12,17H,4-5,7-8H2.
What are the key properties of 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine?
3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine has a molecular weight of 295.35 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-piperidin-4-yloxypyrimidin-4-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 44586278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).