2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol

C22H23N3O2 — CID 11710246

IUPAC2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol
SMILESOC(c1cccnc1)(c1cccnc1)C(c1ccccc1)N1CCOCC1
InChIInChI=1S/C22H23N3O2/c26-22(19-8-4-10-23-16-19,20-9-5-11-24-17-20)21(18-6-2-1-3-7-18)25-12-14-27-15-13-25/h1-11,16-17,21,26H,12-15H2
InChIKeyWPLZJOHYEBBPRT-UHFFFAOYSA-N
MW361.44 g/mol
LogP2.79
Rot. Bonds5

About 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol

2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol (PubChem CID 11710246) has the molecular formula C22H23N3O2 and a molecular weight of 361.44 g/mol. Its IUPAC name is 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol.

Molecular Properties

Compound Name2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol
PubChem CID11710246
Molecular FormulaC22H23N3O2
Molecular Weight361.44 g/mol
Exact Mass361.18
IUPAC Name2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol
SMILESOC(c1cccnc1)(c1cccnc1)C(c1ccccc1)N1CCOCC1
InChIInChI=1S/C22H23N3O2/c26-22(19-8-4-10-23-16-19,20-9-5-11-24-17-20)21(18-6-2-1-3-7-18)25-12-14-27-15-13-25/h1-11,16-17,21,26H,12-15H2
InChIKeyWPLZJOHYEBBPRT-UHFFFAOYSA-N
XLogP2.79
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol?
The IUPAC name of 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol (CID 11710246) is 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol.
What is the SMILES notation for 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol?
The canonical SMILES for 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol is OC(c1cccnc1)(c1cccnc1)C(c1ccccc1)N1CCOCC1.
What is the InChIKey of 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol?
The InChIKey is WPLZJOHYEBBPRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c26-22(19-8-4-10-23-16-19,20-9-5-11-24-17-20)21(18-6-2-1-3-7-18)25-12-14-27-15-13-25/h1-11,16-17,21,26H,12-15H2.
What are the key properties of 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol?
2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol has a molecular weight of 361.44 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-2-phenyl-1,1-dipyridin-3-ylethanol is sourced from PubChem (CID 11710246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).