2-(3-morpholin-4-yl-1-phenylpropyl)phenol

C19H23NO2 — CID 567625

IUPAC2-(3-morpholin-4-yl-1-phenylpropyl)phenol
SMILESOc1ccccc1C(CCN1CCOCC1)c1ccccc1
InChIInChI=1S/C19H23NO2/c21-19-9-5-4-8-18(19)17(16-6-2-1-3-7-16)10-11-20-12-14-22-15-13-20/h1-9,17,21H,10-15H2
InChIKeyLSQLFSBHUSWZLU-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.25
Rot. Bonds5

About 2-(3-morpholin-4-yl-1-phenylpropyl)phenol

2-(3-morpholin-4-yl-1-phenylpropyl)phenol (PubChem CID 567625) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-(3-morpholin-4-yl-1-phenylpropyl)phenol.

Molecular Properties

Compound Name2-(3-morpholin-4-yl-1-phenylpropyl)phenol
PubChem CID567625
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-(3-morpholin-4-yl-1-phenylpropyl)phenol
SMILESOc1ccccc1C(CCN1CCOCC1)c1ccccc1
InChIInChI=1S/C19H23NO2/c21-19-9-5-4-8-18(19)17(16-6-2-1-3-7-16)10-11-20-12-14-22-15-13-20/h1-9,17,21H,10-15H2
InChIKeyLSQLFSBHUSWZLU-UHFFFAOYSA-N
XLogP3.25
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-morpholin-4-yl-1-phenylpropyl)phenol?
The IUPAC name of 2-(3-morpholin-4-yl-1-phenylpropyl)phenol (CID 567625) is 2-(3-morpholin-4-yl-1-phenylpropyl)phenol.
What is the SMILES notation for 2-(3-morpholin-4-yl-1-phenylpropyl)phenol?
The canonical SMILES for 2-(3-morpholin-4-yl-1-phenylpropyl)phenol is Oc1ccccc1C(CCN1CCOCC1)c1ccccc1.
What is the InChIKey of 2-(3-morpholin-4-yl-1-phenylpropyl)phenol?
The InChIKey is LSQLFSBHUSWZLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c21-19-9-5-4-8-18(19)17(16-6-2-1-3-7-16)10-11-20-12-14-22-15-13-20/h1-9,17,21H,10-15H2.
What are the key properties of 2-(3-morpholin-4-yl-1-phenylpropyl)phenol?
2-(3-morpholin-4-yl-1-phenylpropyl)phenol has a molecular weight of 297.40 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-morpholin-4-yl-1-phenylpropyl)phenol is sourced from PubChem (CID 567625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).