[4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine

C14H22N2O2 — CID 114397886

IUPAC[4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine
SMILESCOCc1ccccc1CN1CCOC(CN)C1
InChIInChI=1S/C14H22N2O2/c1-17-11-13-5-3-2-4-12(13)9-16-6-7-18-14(8-15)10-16/h2-5,14H,6-11,15H2,1H3
InChIKeyXCWMGATZFOSGGQ-UHFFFAOYSA-N
MW250.34 g/mol
LogP0.99
Rot. Bonds5

About [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine

[4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine (PubChem CID 114397886) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine
PubChem CID114397886
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name[4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine
SMILESCOCc1ccccc1CN1CCOC(CN)C1
InChIInChI=1S/C14H22N2O2/c1-17-11-13-5-3-2-4-12(13)9-16-6-7-18-14(8-15)10-16/h2-5,14H,6-11,15H2,1H3
InChIKeyXCWMGATZFOSGGQ-UHFFFAOYSA-N
XLogP0.99
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[(2,3,4-trimethoxyphenyl)methyl]morpholin-2-yl]methanamine
CID 114393343
[4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine
CID 79235234
[3-[(2-ethylmorpholin-4-yl)methyl]-2-fluorophenyl]methanamine
CID 107113113
[4-[(4-methyl-3-pyridinyl)methyl]morpholin-2-yl]methanamine;hydrochloride
CID 120844442
1-[1-[[2-(methoxymethyl)phenyl]methyl]pyrrolidin-3-yl]ethanamine
CID 103975618
[4-[(2,4-dichlorophenyl)methyl]morpholin-2-yl]methanamine
CID 114393379
[4-(thiophen-2-ylmethyl)morpholin-2-yl]methanamine;dihydrochloride
CID 71432312
[4-[(2,4,6-trimethoxyphenyl)methyl]morpholin-2-yl]methanamine
CID 114393408
[4-[(1,3-dimethylpyrazol-4-yl)methyl]morpholin-2-yl]methanamine
CID 114393371
2-[2-[(2-ethylmorpholin-4-yl)methyl]phenyl]acetohydrazide
CID 115465353
[(2S)-4-[(5-chloro-2-ethoxyphenyl)methyl]morpholin-2-yl]methanamine;hydrochloride
CID 171625171
[4-[(4-propan-2-ylphenyl)methyl]morpholin-2-yl]methanamine
CID 61338959

Frequently Asked Questions

What is the IUPAC name of [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine?
The IUPAC name of [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine (CID 114397886) is [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine.
What is the SMILES notation for [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine?
The canonical SMILES for [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine is COCc1ccccc1CN1CCOC(CN)C1.
What is the InChIKey of [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine?
The InChIKey is XCWMGATZFOSGGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-17-11-13-5-3-2-4-12(13)9-16-6-7-18-14(8-15)10-16/h2-5,14H,6-11,15H2,1H3.
What are the key properties of [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine?
[4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine has a molecular weight of 250.34 g/mol, XLogP of 0.99, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine is sourced from PubChem (CID 114397886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).