(2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine

C15H19ClFNO2 — CID 124830182

IUPAC(2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine
SMILESFc1ccc(Cl)c(CN2CCO[C@@H]([C@H]3CCCO3)C2)c1
InChIInChI=1S/C15H19ClFNO2/c16-13-4-3-12(17)8-11(13)9-18-5-7-20-15(10-18)14-2-1-6-19-14/h3-4,8,14-15H,1-2,5-7,9-10H2/t14-,15-/m1/s1
InChIKeyZYYRNWLDZGRIMC-HUUCEWRRSA-N
MW299.77 g/mol
LogP2.86
Rot. Bonds3

About (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine

(2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine (PubChem CID 124830182) has the molecular formula C15H19ClFNO2 and a molecular weight of 299.77 g/mol. Its IUPAC name is (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine.

Molecular Properties

Compound Name(2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine
PubChem CID124830182
Molecular FormulaC15H19ClFNO2
Molecular Weight299.77 g/mol
Exact Mass299.11
IUPAC Name(2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine
SMILESFc1ccc(Cl)c(CN2CCO[C@@H]([C@H]3CCCO3)C2)c1
InChIInChI=1S/C15H19ClFNO2/c16-13-4-3-12(17)8-11(13)9-18-5-7-20-15(10-18)14-2-1-6-19-14/h3-4,8,14-15H,1-2,5-7,9-10H2/t14-,15-/m1/s1
InChIKeyZYYRNWLDZGRIMC-HUUCEWRRSA-N
XLogP2.86
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.77
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-1-[(2-chloro-5-fluorophenyl)methyl]pyrrolidine
CID 102620188
(3R)-1-[(2-chloro-5-fluorophenyl)methyl]piperidin-3-amine;hydrochloride
CID 120967115
(2S)-4-[(2-chloro-5-fluorophenyl)methyl]-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholine
CID 99827008
1-[(2-chloro-5-fluorophenyl)methyl]pyrrolidin-3-amine;hydrochloride
CID 120966061
4-[(2-chloro-5-fluorophenyl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 122150903
[1-[(2-chloro-5-fluorophenyl)methyl]pyrrolidin-3-yl]methanamine
CID 102616960
1-[(2-chloro-5-fluorophenyl)methyl]-3-pyrrolidin-2-ylpiperidine
CID 102616953
1-(4-fluorophenyl)-3-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]propan-1-one
CID 124776743
4-[(2-chloro-4-fluorophenyl)methyl]-2-(chloromethyl)morpholine
CID 81214267
4-[(4-chloro-2-fluorophenyl)methyl]-2-cyclopropylmorpholine
CID 131930506
(2R)-4-[(2-morpholin-4-ylphenyl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
CID 97147456
(2S)-4-[(5-bromofuran-2-yl)methyl]-2-[(2S)-oxolan-2-yl]morpholine
CID 99832541

Frequently Asked Questions

What is the IUPAC name of (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine?
The IUPAC name of (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine (CID 124830182) is (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine.
What is the SMILES notation for (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine?
The canonical SMILES for (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine is Fc1ccc(Cl)c(CN2CCO[C@@H]([C@H]3CCCO3)C2)c1.
What is the InChIKey of (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine?
The InChIKey is ZYYRNWLDZGRIMC-HUUCEWRRSA-N. The full InChI is InChI=1S/C15H19ClFNO2/c16-13-4-3-12(17)8-11(13)9-18-5-7-20-15(10-18)14-2-1-6-19-14/h3-4,8,14-15H,1-2,5-7,9-10H2/t14-,15-/m1/s1.
What are the key properties of (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine?
(2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine has a molecular weight of 299.77 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[(2-chloro-5-fluorophenyl)methyl]-2-[(2R)-oxolan-2-yl]morpholine is sourced from PubChem (CID 124830182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).