2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine

C12H15F2NO2 — CID 67073211

IUPAC2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine
SMILESCOc1cc(F)c(CC2CNCCO2)cc1F
InChIInChI=1S/C12H15F2NO2/c1-16-12-6-10(13)8(5-11(12)14)4-9-7-15-2-3-17-9/h5-6,9,15H,2-4,7H2,1H3
InChIKeyURLDXSGKDYUWHI-UHFFFAOYSA-N
MW243.25 g/mol
LogP1.50
Rot. Bonds3

About 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine

2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine (PubChem CID 67073211) has the molecular formula C12H15F2NO2 and a molecular weight of 243.25 g/mol. Its IUPAC name is 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine.

Molecular Properties

Compound Name2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine
PubChem CID67073211
Molecular FormulaC12H15F2NO2
Molecular Weight243.25 g/mol
Exact Mass243.11
IUPAC Name2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine
SMILESCOc1cc(F)c(CC2CNCCO2)cc1F
InChIInChI=1S/C12H15F2NO2/c1-16-12-6-10(13)8(5-11(12)14)4-9-7-15-2-3-17-9/h5-6,9,15H,2-4,7H2,1H3
InChIKeyURLDXSGKDYUWHI-UHFFFAOYSA-N
XLogP1.50
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.25
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-[(2-methoxyphenyl)methyl]morpholine
CID 58689699
2-[(2-chloro-5-fluoro-4-methylphenyl)methyl]morpholine
CID 116927908
4-methoxy-3-(morpholin-2-ylmethyl)aniline;hydrochloride
CID 70130204
2-[(3-fluoro-4-methoxyphenyl)methyl]-1,4-oxazepane
CID 90877171
1-(3-fluoro-4-methoxyphenyl)-2-morpholin-2-ylethanamine
CID 116941576
4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol
CID 70584076
(2S)-2-[[2-(2-bromo-4-fluorophenoxy)-3-methoxyphenyl]methyl]morpholine
CID 68597863
(2R)-2-[[4-methoxy-3-(trifluoromethyl)phenyl]methyl]morpholine
CID 11565325
2-(3-fluoro-4-methoxyphenyl)-N-(morpholin-2-ylmethyl)ethanamine
CID 115237709
N-[(3-fluoro-4-methoxyphenyl)methyl]-2-morpholin-2-ylethanamine
CID 115239190
6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one
CID 175490030
2-(3-fluoro-5-methoxy-4-methylphenyl)morpholine
CID 117323473

Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine?
The IUPAC name of 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine (CID 67073211) is 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine.
What is the SMILES notation for 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine?
The canonical SMILES for 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine is COc1cc(F)c(CC2CNCCO2)cc1F.
What is the InChIKey of 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine?
The InChIKey is URLDXSGKDYUWHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F2NO2/c1-16-12-6-10(13)8(5-11(12)14)4-9-7-15-2-3-17-9/h5-6,9,15H,2-4,7H2,1H3.
What are the key properties of 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine?
2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine has a molecular weight of 243.25 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine is sourced from PubChem (CID 67073211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).