1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol

C15H27N3O2 — CID 75389443

IUPAC1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol
SMILESCCCc1nccn1CC(O)CN1CC(C)OC(C)C1
InChIInChI=1S/C15H27N3O2/c1-4-5-15-16-6-7-18(15)11-14(19)10-17-8-12(2)20-13(3)9-17/h6-7,12-14,19H,4-5,8-11H2,1-3H3
InChIKeyRTOIJHSTFSBJHW-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.31
Rot. Bonds6

About 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol

1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol (PubChem CID 75389443) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol
PubChem CID75389443
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol
SMILESCCCc1nccn1CC(O)CN1CC(C)OC(C)C1
InChIInChI=1S/C15H27N3O2/c1-4-5-15-16-6-7-18(15)11-14(19)10-17-8-12(2)20-13(3)9-17/h6-7,12-14,19H,4-5,8-11H2,1-3H3
InChIKeyRTOIJHSTFSBJHW-UHFFFAOYSA-N
XLogP1.31
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol (CID 75389443) is 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol is CCCc1nccn1CC(O)CN1CC(C)OC(C)C1.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol?
The InChIKey is RTOIJHSTFSBJHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-4-5-15-16-6-7-18(15)11-14(19)10-17-8-12(2)20-13(3)9-17/h6-7,12-14,19H,4-5,8-11H2,1-3H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol?
1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol has a molecular weight of 281.40 g/mol, XLogP of 1.31, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylmorpholin-4-yl)-3-(2-propylimidazol-1-yl)propan-2-ol is sourced from PubChem (CID 75389443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).