1-morpholin-4-yl-2,3-diphenylpentan-3-ol

C21H27NO2 — CID 23604838

IUPAC1-morpholin-4-yl-2,3-diphenylpentan-3-ol
SMILESCCC(O)(c1ccccc1)C(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C21H27NO2/c1-2-21(23,19-11-7-4-8-12-19)20(18-9-5-3-6-10-18)17-22-13-15-24-16-14-22/h3-12,20,23H,2,13-17H2,1H3
InChIKeyIZFLSEIGJMOVRV-UHFFFAOYSA-N
MW325.45 g/mol
LogP3.40
Rot. Bonds6

About 1-morpholin-4-yl-2,3-diphenylpentan-3-ol

1-morpholin-4-yl-2,3-diphenylpentan-3-ol (PubChem CID 23604838) has the molecular formula C21H27NO2 and a molecular weight of 325.45 g/mol. Its IUPAC name is 1-morpholin-4-yl-2,3-diphenylpentan-3-ol.

Molecular Properties

Compound Name1-morpholin-4-yl-2,3-diphenylpentan-3-ol
PubChem CID23604838
Molecular FormulaC21H27NO2
Molecular Weight325.45 g/mol
Exact Mass325.20
IUPAC Name1-morpholin-4-yl-2,3-diphenylpentan-3-ol
SMILESCCC(O)(c1ccccc1)C(CN1CCOCC1)c1ccccc1
InChIInChI=1S/C21H27NO2/c1-2-21(23,19-11-7-4-8-12-19)20(18-9-5-3-6-10-18)17-22-13-15-24-16-14-22/h3-12,20,23H,2,13-17H2,1H3
InChIKeyIZFLSEIGJMOVRV-UHFFFAOYSA-N
XLogP3.40
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.45
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2,3-diphenylpentan-3-ol?
The IUPAC name of 1-morpholin-4-yl-2,3-diphenylpentan-3-ol (CID 23604838) is 1-morpholin-4-yl-2,3-diphenylpentan-3-ol.
What is the SMILES notation for 1-morpholin-4-yl-2,3-diphenylpentan-3-ol?
The canonical SMILES for 1-morpholin-4-yl-2,3-diphenylpentan-3-ol is CCC(O)(c1ccccc1)C(CN1CCOCC1)c1ccccc1.
What is the InChIKey of 1-morpholin-4-yl-2,3-diphenylpentan-3-ol?
The InChIKey is IZFLSEIGJMOVRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO2/c1-2-21(23,19-11-7-4-8-12-19)20(18-9-5-3-6-10-18)17-22-13-15-24-16-14-22/h3-12,20,23H,2,13-17H2,1H3.
What are the key properties of 1-morpholin-4-yl-2,3-diphenylpentan-3-ol?
1-morpholin-4-yl-2,3-diphenylpentan-3-ol has a molecular weight of 325.45 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2,3-diphenylpentan-3-ol is sourced from PubChem (CID 23604838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).