1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol

C20H32N2O3 — CID 110908286

IUPAC1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol
SMILESOC(CN1CCOCC1)CN1CCC(OCCc2ccccc2)CC1
InChIInChI=1S/C20H32N2O3/c23-19(17-22-11-14-24-15-12-22)16-21-9-6-20(7-10-21)25-13-8-18-4-2-1-3-5-18/h1-5,19-20,23H,6-17H2
InChIKeyYNOUBUNGVVZCLJ-UHFFFAOYSA-N
MW348.49 g/mol
LogP1.40
Rot. Bonds8

About 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol

1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol (PubChem CID 110908286) has the molecular formula C20H32N2O3 and a molecular weight of 348.49 g/mol. Its IUPAC name is 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol
PubChem CID110908286
Molecular FormulaC20H32N2O3
Molecular Weight348.49 g/mol
Exact Mass348.24
IUPAC Name1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol
SMILESOC(CN1CCOCC1)CN1CCC(OCCc2ccccc2)CC1
InChIInChI=1S/C20H32N2O3/c23-19(17-22-11-14-24-15-12-22)16-21-9-6-20(7-10-21)25-13-8-18-4-2-1-3-5-18/h1-5,19-20,23H,6-17H2
InChIKeyYNOUBUNGVVZCLJ-UHFFFAOYSA-N
XLogP1.40
TPSA45.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.49
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol?
The IUPAC name of 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol (CID 110908286) is 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol.
What is the SMILES notation for 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol?
The canonical SMILES for 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol is OC(CN1CCOCC1)CN1CCC(OCCc2ccccc2)CC1.
What is the InChIKey of 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol?
The InChIKey is YNOUBUNGVVZCLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O3/c23-19(17-22-11-14-24-15-12-22)16-21-9-6-20(7-10-21)25-13-8-18-4-2-1-3-5-18/h1-5,19-20,23H,6-17H2.
What are the key properties of 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol?
1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol has a molecular weight of 348.49 g/mol, XLogP of 1.40, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-3-[4-(2-phenylethoxy)piperidin-1-yl]propan-2-ol is sourced from PubChem (CID 110908286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).