(2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine

C18H20FNO2S — CID 10248552

IUPAC(2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine
SMILESCOc1ccccc1S[C@H](c1ccccc1F)[C@H]1CNCCO1
InChIInChI=1S/C18H20FNO2S/c1-21-15-8-4-5-9-17(15)23-18(16-12-20-10-11-22-16)13-6-2-3-7-14(13)19/h2-9,16,18,20H,10-12H2,1H3/t16-,18-/m1/s1
InChIKeyMJKOYJRFMCWECO-SJLPKXTDSA-N
MW333.43 g/mol
LogP3.66
Rot. Bonds5

About (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine

(2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine (PubChem CID 10248552) has the molecular formula C18H20FNO2S and a molecular weight of 333.43 g/mol. Its IUPAC name is (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine.

Molecular Properties

Compound Name(2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine
PubChem CID10248552
Molecular FormulaC18H20FNO2S
Molecular Weight333.43 g/mol
Exact Mass333.12
IUPAC Name(2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine
SMILESCOc1ccccc1S[C@H](c1ccccc1F)[C@H]1CNCCO1
InChIInChI=1S/C18H20FNO2S/c1-21-15-8-4-5-9-17(15)23-18(16-12-20-10-11-22-16)13-6-2-3-7-14(13)19/h2-9,16,18,20H,10-12H2,1H3/t16-,18-/m1/s1
InChIKeyMJKOYJRFMCWECO-SJLPKXTDSA-N
XLogP3.66
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(R)-(4-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine
CID 91583173
(2S)-2-[(S)-(2-methoxyphenyl)sulfanyl-phenylmethyl]morpholine
CID 11594827
(2S)-4-benzyl-2-[(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine
CID 69130802
2-[(2-ethoxy-6-fluorophenoxy)-phenylmethyl]morpholine
CID 56678217
2-[(2-ethoxy-3-fluorophenoxy)-phenylmethyl]morpholine
CID 68542255
(2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine
CID 69432021
1-(2,5-difluorophenyl)-N,N-dimethyl-1-morpholin-2-ylmethanamine
CID 116910838
(2R)-2-[(R)-(2-chlorophenyl)sulfanyl-(3-fluorophenyl)methyl]morpholine
CID 58610144
2-[(2-ethoxyphenoxy)-(4-methoxyphenyl)methyl]morpholine
CID 10066040
2-[(S)-(4-fluoro-2-methoxyphenoxy)-(3-fluorophenyl)methyl]morpholine
CID 90905333
2-[(S)-(2,6-difluorophenoxy)-phenylmethyl]morpholine
CID 68542729
(2S)-2-[(2-ethoxy-5-fluorophenoxy)-phenylmethyl]morpholine
CID 59166814

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine?
The IUPAC name of (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine (CID 10248552) is (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine.
What is the SMILES notation for (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine?
The canonical SMILES for (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine is COc1ccccc1S[C@H](c1ccccc1F)[C@H]1CNCCO1.
What is the InChIKey of (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine?
The InChIKey is MJKOYJRFMCWECO-SJLPKXTDSA-N. The full InChI is InChI=1S/C18H20FNO2S/c1-21-15-8-4-5-9-17(15)23-18(16-12-20-10-11-22-16)13-6-2-3-7-14(13)19/h2-9,16,18,20H,10-12H2,1H3/t16-,18-/m1/s1.
What are the key properties of (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine?
(2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine has a molecular weight of 333.43 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(R)-(2-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine is sourced from PubChem (CID 10248552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).