(2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine

C19H23NOS — CID 69432021

IUPAC(2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine
SMILESCCc1ccccc1SC(c1ccccc1)[C@H]1CNCCO1
InChIInChI=1S/C19H23NOS/c1-2-15-8-6-7-11-18(15)22-19(16-9-4-3-5-10-16)17-14-20-12-13-21-17/h3-11,17,19-20H,2,12-14H2,1H3/t17-,19?/m1/s1
InChIKeyFQPOMYWVOPCCHO-DUSLRRAJSA-N
MW313.47 g/mol
LogP4.07
Rot. Bonds5

About (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine

(2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine (PubChem CID 69432021) has the molecular formula C19H23NOS and a molecular weight of 313.47 g/mol. Its IUPAC name is (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine.

Molecular Properties

Compound Name(2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine
PubChem CID69432021
Molecular FormulaC19H23NOS
Molecular Weight313.47 g/mol
Exact Mass313.15
IUPAC Name(2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine
SMILESCCc1ccccc1SC(c1ccccc1)[C@H]1CNCCO1
InChIInChI=1S/C19H23NOS/c1-2-15-8-6-7-11-18(15)22-19(16-9-4-3-5-10-16)17-14-20-12-13-21-17/h3-11,17,19-20H,2,12-14H2,1H3/t17-,19?/m1/s1
InChIKeyFQPOMYWVOPCCHO-DUSLRRAJSA-N
XLogP4.07
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.47
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[(S)-(2-methoxyphenyl)sulfanyl-phenylmethyl]morpholine
CID 11594827
2-(1-phenylpropyl)morpholine
CID 70531832
2-[(3-benzyl-2-pyridinyl)sulfanyl-phenylmethyl]morpholine
CID 76566166
2-[(R)-(4-fluorophenyl)-(2-methoxyphenyl)sulfanylmethyl]morpholine
CID 91583173
(2R)-2-[(R)-(2-chlorophenyl)sulfanyl-(3-fluorophenyl)methyl]morpholine
CID 58610144
(R)-morpholin-2-yl(phenyl)methanol
CID 69108289
(2S)-2-[[3-(4-fluorophenyl)-2-pyridinyl]sulfanyl-phenylmethyl]morpholine
CID 68822760
2-[[2-(methoxymethyl)phenoxy]-phenylmethyl]morpholine
CID 11709415
(2R)-2-[(R)-(2-ethoxyphenoxy)-phenylmethyl]morpholine;hydrochloride
CID 46178247
(2S)-2-[[2-(2-methylpropyl)phenoxy]-phenylmethyl]morpholine
CID 68538263
2-[(S)-phenyl(pyrazol-1-yl)methyl]morpholine
CID 141401677
2-[2-(2-phenoxyphenyl)-1-phenylethyl]morpholine
CID 68903551

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine?
The IUPAC name of (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine (CID 69432021) is (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine.
What is the SMILES notation for (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine?
The canonical SMILES for (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine is CCc1ccccc1SC(c1ccccc1)[C@H]1CNCCO1.
What is the InChIKey of (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine?
The InChIKey is FQPOMYWVOPCCHO-DUSLRRAJSA-N. The full InChI is InChI=1S/C19H23NOS/c1-2-15-8-6-7-11-18(15)22-19(16-9-4-3-5-10-16)17-14-20-12-13-21-17/h3-11,17,19-20H,2,12-14H2,1H3/t17-,19?/m1/s1.
What are the key properties of (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine?
(2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine has a molecular weight of 313.47 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine is sourced from PubChem (CID 69432021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).