2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine

C15H22FNO2 — CID 64854529

IUPAC2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine
SMILESCc1ccc(F)c(OCC2CN(C(C)C)CCO2)c1
InChIInChI=1S/C15H22FNO2/c1-11(2)17-6-7-18-13(9-17)10-19-15-8-12(3)4-5-14(15)16/h4-5,8,11,13H,6-7,9-10H2,1-3H3
InChIKeyMAYUJGRPVNYFNE-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.62
Rot. Bonds4

About 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine

2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine (PubChem CID 64854529) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine.

Molecular Properties

Compound Name2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine
PubChem CID64854529
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine
SMILESCc1ccc(F)c(OCC2CN(C(C)C)CCO2)c1
InChIInChI=1S/C15H22FNO2/c1-11(2)17-6-7-18-13(9-17)10-19-15-8-12(3)4-5-14(15)16/h4-5,8,11,13H,6-7,9-10H2,1-3H3
InChIKeyMAYUJGRPVNYFNE-UHFFFAOYSA-N
XLogP2.62
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2-[(4-propan-2-ylmorpholin-2-yl)methoxy]benzoic acid
CID 64533676
(1S)-1-[5-methyl-2-[(4-propan-2-ylmorpholin-2-yl)methoxy]phenyl]ethanamine
CID 78996510
2-[(3-fluoro-4-methylphenoxy)methyl]-4-propan-2-ylmorpholine
CID 107171230
(2R)-1-[(2S)-2-[(2-fluoro-5-methylphenoxy)methyl]morpholin-4-yl]-3-methoxypropan-2-ol
CID 98735681
[5-fluoro-2-[(4-propan-2-ylmorpholin-2-yl)methoxy]phenyl]boronic acid
CID 64535556
2-[(2,3-dimethylphenoxy)methyl]-4-propan-2-ylmorpholine
CID 103432287
2-[5-fluoro-2-[(4-propan-2-ylmorpholin-2-yl)methoxy]phenyl]ethanamine
CID 107700549
4-fluoro-2-[(4-propan-2-ylmorpholin-2-yl)methoxy]benzoic acid
CID 107014520
2-fluoro-4-methyl-N-[(4-propan-2-ylmorpholin-2-yl)methyl]aniline
CID 64533093
3-methyl-4-[(4-propan-2-ylmorpholin-2-yl)methoxy]benzoic acid
CID 107673545
[3-methyl-4-[(4-propan-2-ylmorpholin-2-yl)methoxy]phenyl]boronic acid
CID 64535557
4-propan-2-yl-2-[(2-propan-2-ylphenoxy)methyl]morpholine
CID 64763487

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine?
The IUPAC name of 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine (CID 64854529) is 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine.
What is the SMILES notation for 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine?
The canonical SMILES for 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine is Cc1ccc(F)c(OCC2CN(C(C)C)CCO2)c1.
What is the InChIKey of 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine?
The InChIKey is MAYUJGRPVNYFNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-11(2)17-6-7-18-13(9-17)10-19-15-8-12(3)4-5-14(15)16/h4-5,8,11,13H,6-7,9-10H2,1-3H3.
What are the key properties of 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine?
2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine has a molecular weight of 267.34 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluoro-5-methylphenoxy)methyl]-4-propan-2-ylmorpholine is sourced from PubChem (CID 64854529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).