4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine

C18H28N2O — CID 71653292

IUPAC4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine
SMILESCCCN1CCC(c2cccc(N3CCOCC3)c2)CC1
InChIInChI=1S/C18H28N2O/c1-2-8-19-9-6-16(7-10-19)17-4-3-5-18(15-17)20-11-13-21-14-12-20/h3-5,15-16H,2,6-14H2,1H3
InChIKeyZTTXIBYFXYSZSL-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.11
Rot. Bonds4

About 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine

4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine (PubChem CID 71653292) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine.

Molecular Properties

Compound Name4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine
PubChem CID71653292
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine
SMILESCCCN1CCC(c2cccc(N3CCOCC3)c2)CC1
InChIInChI=1S/C18H28N2O/c1-2-8-19-9-6-16(7-10-19)17-4-3-5-18(15-17)20-11-13-21-14-12-20/h3-5,15-16H,2,6-14H2,1H3
InChIKeyZTTXIBYFXYSZSL-UHFFFAOYSA-N
XLogP3.11
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine?
The IUPAC name of 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine (CID 71653292) is 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine.
What is the SMILES notation for 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine?
The canonical SMILES for 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine is CCCN1CCC(c2cccc(N3CCOCC3)c2)CC1.
What is the InChIKey of 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine?
The InChIKey is ZTTXIBYFXYSZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-2-8-19-9-6-16(7-10-19)17-4-3-5-18(15-17)20-11-13-21-14-12-20/h3-5,15-16H,2,6-14H2,1H3.
What are the key properties of 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine?
4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine has a molecular weight of 288.44 g/mol, XLogP of 3.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(1-propylpiperidin-4-yl)phenyl]morpholine is sourced from PubChem (CID 71653292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).