4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine

C17H24N6O2 — CID 71988974

IUPAC4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine
SMILESCc1cnc(CN2CCN(c3cc(N4CCOCC4)ncn3)CC2)o1
InChIInChI=1S/C17H24N6O2/c1-14-11-18-17(25-14)12-21-2-4-22(5-3-21)15-10-16(20-13-19-15)23-6-8-24-9-7-23/h10-11,13H,2-9,12H2,1H3
InChIKeyIYGQEEMAMVUBJC-UHFFFAOYSA-N
MW344.42 g/mol
LogP0.93
Rot. Bonds4

About 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine

4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine (PubChem CID 71988974) has the molecular formula C17H24N6O2 and a molecular weight of 344.42 g/mol. Its IUPAC name is 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine
PubChem CID71988974
Molecular FormulaC17H24N6O2
Molecular Weight344.42 g/mol
Exact Mass344.20
IUPAC Name4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine
SMILESCc1cnc(CN2CCN(c3cc(N4CCOCC4)ncn3)CC2)o1
InChIInChI=1S/C17H24N6O2/c1-14-11-18-17(25-14)12-21-2-4-22(5-3-21)15-10-16(20-13-19-15)23-6-8-24-9-7-23/h10-11,13H,2-9,12H2,1H3
InChIKeyIYGQEEMAMVUBJC-UHFFFAOYSA-N
XLogP0.93
TPSA70.76 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine 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 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine (CID 71988974) is 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine is Cc1cnc(CN2CCN(c3cc(N4CCOCC4)ncn3)CC2)o1.
What is the InChIKey of 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine?
The InChIKey is IYGQEEMAMVUBJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O2/c1-14-11-18-17(25-14)12-21-2-4-22(5-3-21)15-10-16(20-13-19-15)23-6-8-24-9-7-23/h10-11,13H,2-9,12H2,1H3.
What are the key properties of 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine?
4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine has a molecular weight of 344.42 g/mol, XLogP of 0.93, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[4-[(5-methyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]morpholine is sourced from PubChem (CID 71988974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).