2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol

C18H22N2O2 — CID 70794231

IUPAC2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol
SMILESCC(N1CCOCC1)C(O)(c1ccccc1)c1ccncc1
InChIInChI=1S/C18H22N2O2/c1-15(20-11-13-22-14-12-20)18(21,16-5-3-2-4-6-16)17-7-9-19-10-8-17/h2-10,15,21H,11-14H2,1H3
InChIKeyQMIPPHPYUOSUKV-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.04
Rot. Bonds4

About 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol

2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol (PubChem CID 70794231) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol.

Molecular Properties

Compound Name2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol
PubChem CID70794231
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol
SMILESCC(N1CCOCC1)C(O)(c1ccccc1)c1ccncc1
InChIInChI=1S/C18H22N2O2/c1-15(20-11-13-22-14-12-20)18(21,16-5-3-2-4-6-16)17-7-9-19-10-8-17/h2-10,15,21H,11-14H2,1H3
InChIKeyQMIPPHPYUOSUKV-UHFFFAOYSA-N
XLogP2.04
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol?
The IUPAC name of 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol (CID 70794231) is 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol.
What is the SMILES notation for 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol?
The canonical SMILES for 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol is CC(N1CCOCC1)C(O)(c1ccccc1)c1ccncc1.
What is the InChIKey of 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol?
The InChIKey is QMIPPHPYUOSUKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-15(20-11-13-22-14-12-20)18(21,16-5-3-2-4-6-16)17-7-9-19-10-8-17/h2-10,15,21H,11-14H2,1H3.
What are the key properties of 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol?
2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol has a molecular weight of 298.39 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-1-phenyl-1-pyridin-4-ylpropan-1-ol is sourced from PubChem (CID 70794231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).