(4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine

C13H20N2O2 — CID 79093138

IUPAC(4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine
SMILESCOc1ccc(C(N)C2CN(C)CCO2)cc1
InChIInChI=1S/C13H20N2O2/c1-15-7-8-17-12(9-15)13(14)10-3-5-11(16-2)6-4-10/h3-6,12-13H,7-9,14H2,1-2H3
InChIKeyPXLAIVXRFCVTFY-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.03
Rot. Bonds3

About (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine

(4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine (PubChem CID 79093138) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine
PubChem CID79093138
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name(4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine
SMILESCOc1ccc(C(N)C2CN(C)CCO2)cc1
InChIInChI=1S/C13H20N2O2/c1-15-7-8-17-12(9-15)13(14)10-3-5-11(16-2)6-4-10/h3-6,12-13H,7-9,14H2,1-2H3
InChIKeyPXLAIVXRFCVTFY-UHFFFAOYSA-N
XLogP1.03
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine
CID 79093624
(4-chloro-3-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine
CID 79699140
2-[(4-ethoxyphenyl)-(4-methoxyphenoxy)methyl]-4-methylmorpholine
CID 23458425
(2-fluoro-4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanol
CID 103395437
(4-methylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116544706
1-(2,5-dimethoxyphenyl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine
CID 79092776
(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-methylmorpholin-2-yl)methanamine
CID 114657180
[(5-methoxy-3-pyridinyl)-(4-methylmorpholin-2-yl)methyl]hydrazine
CID 105244575
[2-(2-methoxyethoxy)phenyl]-(4-methylmorpholin-2-yl)methanamine
CID 104660396
(4-methoxyphenyl)-(2-methyloxolan-3-yl)methanamine
CID 79758244
1-(4-methoxyphenyl)-N-methyl-1-(4-propylmorpholin-2-yl)methanamine
CID 79658250
(2-cyclobutylphenyl)-(4-methylmorpholin-2-yl)methanamine
CID 114603817

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine?
The IUPAC name of (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine (CID 79093138) is (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine.
What is the SMILES notation for (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine?
The canonical SMILES for (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine is COc1ccc(C(N)C2CN(C)CCO2)cc1.
What is the InChIKey of (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine?
The InChIKey is PXLAIVXRFCVTFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-15-7-8-17-12(9-15)13(14)10-3-5-11(16-2)6-4-10/h3-6,12-13H,7-9,14H2,1-2H3.
What are the key properties of (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine?
(4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine has a molecular weight of 236.31 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine is sourced from PubChem (CID 79093138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).