4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine

C13H18N4O — CID 134862885

IUPAC4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine
SMILESCC(C)c1ccnc2ncc(N3CCOCC3)n12
InChIInChI=1S/C13H18N4O/c1-10(2)11-3-4-14-13-15-9-12(17(11)13)16-5-7-18-8-6-16/h3-4,9-10H,5-8H2,1-2H3
InChIKeyDUKVESRQMOEFKX-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.69
Rot. Bonds2

About 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine

4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine (PubChem CID 134862885) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine.

Molecular Properties

Compound Name4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine
PubChem CID134862885
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine
SMILESCC(C)c1ccnc2ncc(N3CCOCC3)n12
InChIInChI=1S/C13H18N4O/c1-10(2)11-3-4-14-13-15-9-12(17(11)13)16-5-7-18-8-6-16/h3-4,9-10H,5-8H2,1-2H3
InChIKeyDUKVESRQMOEFKX-UHFFFAOYSA-N
XLogP1.69
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine?
The IUPAC name of 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine (CID 134862885) is 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine.
What is the SMILES notation for 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine?
The canonical SMILES for 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine is CC(C)c1ccnc2ncc(N3CCOCC3)n12.
What is the InChIKey of 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine?
The InChIKey is DUKVESRQMOEFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-10(2)11-3-4-14-13-15-9-12(17(11)13)16-5-7-18-8-6-16/h3-4,9-10H,5-8H2,1-2H3.
What are the key properties of 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine?
4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine has a molecular weight of 246.31 g/mol, XLogP of 1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)morpholine is sourced from PubChem (CID 134862885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).