(3R)-3-(methoxymethyl)-4-phenylmorpholine

C12H17NO2 — CID 173472557

IUPAC(3R)-3-(methoxymethyl)-4-phenylmorpholine
SMILESCOC[C@@H]1COCCN1c1ccccc1
InChIInChI=1S/C12H17NO2/c1-14-9-12-10-15-8-7-13(12)11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3/t12-/m1/s1
InChIKeyJWOWKEMLTADGJH-GFCCVEGCSA-N
MW207.27 g/mol
LogP1.54
Rot. Bonds3

About (3R)-3-(methoxymethyl)-4-phenylmorpholine

(3R)-3-(methoxymethyl)-4-phenylmorpholine (PubChem CID 173472557) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is (3R)-3-(methoxymethyl)-4-phenylmorpholine.

Molecular Properties

Compound Name(3R)-3-(methoxymethyl)-4-phenylmorpholine
PubChem CID173472557
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name(3R)-3-(methoxymethyl)-4-phenylmorpholine
SMILESCOC[C@@H]1COCCN1c1ccccc1
InChIInChI=1S/C12H17NO2/c1-14-9-12-10-15-8-7-13(12)11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3/t12-/m1/s1
InChIKeyJWOWKEMLTADGJH-GFCCVEGCSA-N
XLogP1.54
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-(methoxymethyl)-4-phenylmorpholine?
The IUPAC name of (3R)-3-(methoxymethyl)-4-phenylmorpholine (CID 173472557) is (3R)-3-(methoxymethyl)-4-phenylmorpholine.
What is the SMILES notation for (3R)-3-(methoxymethyl)-4-phenylmorpholine?
The canonical SMILES for (3R)-3-(methoxymethyl)-4-phenylmorpholine is COC[C@@H]1COCCN1c1ccccc1.
What is the InChIKey of (3R)-3-(methoxymethyl)-4-phenylmorpholine?
The InChIKey is JWOWKEMLTADGJH-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H17NO2/c1-14-9-12-10-15-8-7-13(12)11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3/t12-/m1/s1.
What are the key properties of (3R)-3-(methoxymethyl)-4-phenylmorpholine?
(3R)-3-(methoxymethyl)-4-phenylmorpholine has a molecular weight of 207.27 g/mol, XLogP of 1.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(methoxymethyl)-4-phenylmorpholine is sourced from PubChem (CID 173472557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).