4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine

C15H26N4OS — CID 91585272

IUPAC4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine
SMILESCC(C)N1CCN(c2cnc(CN3CCOCC3)s2)CC1
InChIInChI=1S/C15H26N4OS/c1-13(2)18-3-5-19(6-4-18)15-11-16-14(21-15)12-17-7-9-20-10-8-17/h11,13H,3-10,12H2,1-2H3
InChIKeyPFOSCDZNYRQCGR-UHFFFAOYSA-N
MW310.47 g/mol
LogP1.51
Rot. Bonds4

About 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine

4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine (PubChem CID 91585272) has the molecular formula C15H26N4OS and a molecular weight of 310.47 g/mol. Its IUPAC name is 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine
PubChem CID91585272
Molecular FormulaC15H26N4OS
Molecular Weight310.47 g/mol
Exact Mass310.18
IUPAC Name4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine
SMILESCC(C)N1CCN(c2cnc(CN3CCOCC3)s2)CC1
InChIInChI=1S/C15H26N4OS/c1-13(2)18-3-5-19(6-4-18)15-11-16-14(21-15)12-17-7-9-20-10-8-17/h11,13H,3-10,12H2,1-2H3
InChIKeyPFOSCDZNYRQCGR-UHFFFAOYSA-N
XLogP1.51
TPSA31.84 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine?
The IUPAC name of 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine (CID 91585272) is 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine.
What is the SMILES notation for 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine?
The canonical SMILES for 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine is CC(C)N1CCN(c2cnc(CN3CCOCC3)s2)CC1.
What is the InChIKey of 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine?
The InChIKey is PFOSCDZNYRQCGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4OS/c1-13(2)18-3-5-19(6-4-18)15-11-16-14(21-15)12-17-7-9-20-10-8-17/h11,13H,3-10,12H2,1-2H3.
What are the key properties of 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine?
4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine has a molecular weight of 310.47 g/mol, XLogP of 1.51, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazol-2-yl]methyl]morpholine is sourced from PubChem (CID 91585272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).