3-[4-(2-morpholin-4-ylethyl)phenyl]phenol

C18H21NO2 — CID 70092617

IUPAC3-[4-(2-morpholin-4-ylethyl)phenyl]phenol
SMILESOc1cccc(-c2ccc(CCN3CCOCC3)cc2)c1
InChIInChI=1S/C18H21NO2/c20-18-3-1-2-17(14-18)16-6-4-15(5-7-16)8-9-19-10-12-21-13-11-19/h1-7,14,20H,8-13H2
InChIKeyWEWKJEZNXVCSEY-UHFFFAOYSA-N
MW283.37 g/mol
LogP2.93
Rot. Bonds4

About 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol

3-[4-(2-morpholin-4-ylethyl)phenyl]phenol (PubChem CID 70092617) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol.

Molecular Properties

Compound Name3-[4-(2-morpholin-4-ylethyl)phenyl]phenol
PubChem CID70092617
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name3-[4-(2-morpholin-4-ylethyl)phenyl]phenol
SMILESOc1cccc(-c2ccc(CCN3CCOCC3)cc2)c1
InChIInChI=1S/C18H21NO2/c20-18-3-1-2-17(14-18)16-6-4-15(5-7-16)8-9-19-10-12-21-13-11-19/h1-7,14,20H,8-13H2
InChIKeyWEWKJEZNXVCSEY-UHFFFAOYSA-N
XLogP2.93
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol?
The IUPAC name of 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol (CID 70092617) is 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol.
What is the SMILES notation for 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol?
The canonical SMILES for 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol is Oc1cccc(-c2ccc(CCN3CCOCC3)cc2)c1.
What is the InChIKey of 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol?
The InChIKey is WEWKJEZNXVCSEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c20-18-3-1-2-17(14-18)16-6-4-15(5-7-16)8-9-19-10-12-21-13-11-19/h1-7,14,20H,8-13H2.
What are the key properties of 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol?
3-[4-(2-morpholin-4-ylethyl)phenyl]phenol has a molecular weight of 283.37 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-morpholin-4-ylethyl)phenyl]phenol is sourced from PubChem (CID 70092617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).