6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine

C20H24N6O2 — CID 175732372

IUPAC6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine
SMILESNc1cc(-c2cnc3cc(OCC4CCN(C5COC5)CC4)ccn23)ncn1
InChIInChI=1S/C20H24N6O2/c21-19-8-17(23-13-24-19)18-9-22-20-7-16(3-6-26(18)20)28-10-14-1-4-25(5-2-14)15-11-27-12-15/h3,6-9,13-15H,1-2,4-5,10-12H2,(H2,21,23,24)
InChIKeyXXRMDPGNAXLHFY-UHFFFAOYSA-N
MW380.45 g/mol
LogP1.86
Rot. Bonds5

About 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine

6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine (PubChem CID 175732372) has the molecular formula C20H24N6O2 and a molecular weight of 380.45 g/mol. Its IUPAC name is 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine
PubChem CID175732372
Molecular FormulaC20H24N6O2
Molecular Weight380.45 g/mol
Exact Mass380.20
IUPAC Name6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine
SMILESNc1cc(-c2cnc3cc(OCC4CCN(C5COC5)CC4)ccn23)ncn1
InChIInChI=1S/C20H24N6O2/c21-19-8-17(23-13-24-19)18-9-22-20-7-16(3-6-26(18)20)28-10-14-1-4-25(5-2-14)15-11-27-12-15/h3,6-9,13-15H,1-2,4-5,10-12H2,(H2,21,23,24)
InChIKeyXXRMDPGNAXLHFY-UHFFFAOYSA-N
XLogP1.86
TPSA90.80 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine?
The IUPAC name of 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine (CID 175732372) is 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine.
What is the SMILES notation for 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine?
The canonical SMILES for 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine is Nc1cc(-c2cnc3cc(OCC4CCN(C5COC5)CC4)ccn23)ncn1.
What is the InChIKey of 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine?
The InChIKey is XXRMDPGNAXLHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O2/c21-19-8-17(23-13-24-19)18-9-22-20-7-16(3-6-26(18)20)28-10-14-1-4-25(5-2-14)15-11-27-12-15/h3,6-9,13-15H,1-2,4-5,10-12H2,(H2,21,23,24).
What are the key properties of 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine?
6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine has a molecular weight of 380.45 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[7-[[1-(oxetan-3-yl)piperidin-4-yl]methoxy]imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine is sourced from PubChem (CID 175732372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).