4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine

C13H18N4O — CID 134848593

IUPAC4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine
SMILESCCCc1ccn2c(N3CCOCC3)cnc2n1
InChIInChI=1S/C13H18N4O/c1-2-3-11-4-5-17-12(10-14-13(17)15-11)16-6-8-18-9-7-16/h4-5,10H,2-3,6-9H2,1H3
InChIKeyNGVVGTLIFRXDPY-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.52
Rot. Bonds3

About 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine

4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine (PubChem CID 134848593) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine.

Molecular Properties

Compound Name4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine
PubChem CID134848593
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine
SMILESCCCc1ccn2c(N3CCOCC3)cnc2n1
InChIInChI=1S/C13H18N4O/c1-2-3-11-4-5-17-12(10-14-13(17)15-11)16-6-8-18-9-7-16/h4-5,10H,2-3,6-9H2,1H3
InChIKeyNGVVGTLIFRXDPY-UHFFFAOYSA-N
XLogP1.52
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine?
The IUPAC name of 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine (CID 134848593) is 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine.
What is the SMILES notation for 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine?
The canonical SMILES for 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine is CCCc1ccn2c(N3CCOCC3)cnc2n1.
What is the InChIKey of 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine?
The InChIKey is NGVVGTLIFRXDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-2-3-11-4-5-17-12(10-14-13(17)15-11)16-6-8-18-9-7-16/h4-5,10H,2-3,6-9H2,1H3.
What are the key properties of 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine?
4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine has a molecular weight of 246.31 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine is sourced from PubChem (CID 134848593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).