(3R)-3-(3,4-dimethoxyphenyl)morpholine

C12H17NO3 — CID 42183336

IUPAC(3R)-3-(3,4-dimethoxyphenyl)morpholine
SMILESCOc1ccc([C@@H]2COCCN2)cc1OC
InChIInChI=1S/C12H17NO3/c1-14-11-4-3-9(7-12(11)15-2)10-8-16-6-5-13-10/h3-4,7,10,13H,5-6,8H2,1-2H3/t10-/m0/s1
InChIKeyRFZCZSZFQBKDMH-JTQLQIEISA-N
MW223.27 g/mol
LogP1.36
Rot. Bonds3

About (3R)-3-(3,4-dimethoxyphenyl)morpholine

(3R)-3-(3,4-dimethoxyphenyl)morpholine (PubChem CID 42183336) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is (3R)-3-(3,4-dimethoxyphenyl)morpholine.

Molecular Properties

Compound Name(3R)-3-(3,4-dimethoxyphenyl)morpholine
PubChem CID42183336
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name(3R)-3-(3,4-dimethoxyphenyl)morpholine
SMILESCOc1ccc([C@@H]2COCCN2)cc1OC
InChIInChI=1S/C12H17NO3/c1-14-11-4-3-9(7-12(11)15-2)10-8-16-6-5-13-10/h3-4,7,10,13H,5-6,8H2,1-2H3/t10-/m0/s1
InChIKeyRFZCZSZFQBKDMH-JTQLQIEISA-N
XLogP1.36
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride
CID 171193072
(3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride
CID 171192539
3-(4-methoxy-3-propan-2-ylphenyl)morpholine
CID 82083415
3-(3-ethyl-4-methoxyphenyl)morpholine
CID 82286598
(3R)-3-(3-methoxy-4-phenylmethoxyphenyl)morpholine
CID 171192902
(3S)-3-(4-methoxy-3-phenylmethoxyphenyl)morpholine;hydrochloride
CID 171193382
3-(3,4-difluoro-5-methoxyphenyl)morpholine
CID 84792610
(3S)-3-(3,4-dimethylphenyl)morpholine;hydrochloride
CID 171193047
(3S)-3-(3-methoxyphenyl)morpholine
CID 42183281
2-bromo-6-methoxy-4-[(3R)-morpholin-3-yl]phenol
CID 131429409
3-(4-ethoxy-3-fluorophenyl)morpholine
CID 82287553
(2S)-2-(3,4-dimethoxyphenyl)piperidine;hydrochloride
CID 171194815

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(3,4-dimethoxyphenyl)morpholine?
The IUPAC name of (3R)-3-(3,4-dimethoxyphenyl)morpholine (CID 42183336) is (3R)-3-(3,4-dimethoxyphenyl)morpholine.
What is the SMILES notation for (3R)-3-(3,4-dimethoxyphenyl)morpholine?
The canonical SMILES for (3R)-3-(3,4-dimethoxyphenyl)morpholine is COc1ccc([C@@H]2COCCN2)cc1OC.
What is the InChIKey of (3R)-3-(3,4-dimethoxyphenyl)morpholine?
The InChIKey is RFZCZSZFQBKDMH-JTQLQIEISA-N. The full InChI is InChI=1S/C12H17NO3/c1-14-11-4-3-9(7-12(11)15-2)10-8-16-6-5-13-10/h3-4,7,10,13H,5-6,8H2,1-2H3/t10-/m0/s1.
What are the key properties of (3R)-3-(3,4-dimethoxyphenyl)morpholine?
(3R)-3-(3,4-dimethoxyphenyl)morpholine has a molecular weight of 223.27 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(3,4-dimethoxyphenyl)morpholine is sourced from PubChem (CID 42183336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).