(1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride

C19H23ClFNO3 — CID 69290774

IUPAC(1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride
SMILESCOc1ccc(F)cc1C[C@@](O)(c1ccccc1)C1CNCCO1.Cl
InChIInChI=1S/C19H22FNO3.ClH/c1-23-17-8-7-16(20)11-14(17)12-19(22,15-5-3-2-4-6-15)18-13-21-9-10-24-18;/h2-8,11,18,21-22H,9-10,12-13H2,1H3;1H/t18?,19-;/m1./s1
InChIKeyDGTLIUJXAWHXBX-SQTGWKPBSA-N
MW367.85 g/mol
LogP2.67
Rot. Bonds5

About (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride

(1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride (PubChem CID 69290774) has the molecular formula C19H23ClFNO3 and a molecular weight of 367.85 g/mol. Its IUPAC name is (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride.

Molecular Properties

Compound Name(1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride
PubChem CID69290774
Molecular FormulaC19H23ClFNO3
Molecular Weight367.85 g/mol
Exact Mass367.14
IUPAC Name(1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride
SMILESCOc1ccc(F)cc1C[C@@](O)(c1ccccc1)C1CNCCO1.Cl
InChIInChI=1S/C19H22FNO3.ClH/c1-23-17-8-7-16(20)11-14(17)12-19(22,15-5-3-2-4-6-15)18-13-21-9-10-24-18;/h2-8,11,18,21-22H,9-10,12-13H2,1H3;1H/t18?,19-;/m1./s1
InChIKeyDGTLIUJXAWHXBX-SQTGWKPBSA-N
XLogP2.67
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.85
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride?
The IUPAC name of (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride (CID 69290774) is (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride.
What is the SMILES notation for (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride?
The canonical SMILES for (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride is COc1ccc(F)cc1C[C@@](O)(c1ccccc1)C1CNCCO1.Cl.
What is the InChIKey of (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride?
The InChIKey is DGTLIUJXAWHXBX-SQTGWKPBSA-N. The full InChI is InChI=1S/C19H22FNO3.ClH/c1-23-17-8-7-16(20)11-14(17)12-19(22,15-5-3-2-4-6-15)18-13-21-9-10-24-18;/h2-8,11,18,21-22H,9-10,12-13H2,1H3;1H/t18?,19-;/m1./s1.
What are the key properties of (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride?
(1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride has a molecular weight of 367.85 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(5-fluoro-2-methoxyphenyl)-1-morpholin-2-yl-1-phenylethanol;hydrochloride is sourced from PubChem (CID 69290774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).