5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline

C14H22N2O2 — CID 114252444

IUPAC5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline
SMILESCCN1CCOC(COc2ccc(C)c(N)c2)C1
InChIInChI=1S/C14H22N2O2/c1-3-16-6-7-17-13(9-16)10-18-12-5-4-11(2)14(15)8-12/h4-5,8,13H,3,6-7,9-10,15H2,1-2H3
InChIKeyYAKZQHHDOOBECB-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.68
Rot. Bonds4

About 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline

5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline (PubChem CID 114252444) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline.

Molecular Properties

Compound Name5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline
PubChem CID114252444
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline
SMILESCCN1CCOC(COc2ccc(C)c(N)c2)C1
InChIInChI=1S/C14H22N2O2/c1-3-16-6-7-17-13(9-16)10-18-12-5-4-11(2)14(15)8-12/h4-5,8,13H,3,6-7,9-10,15H2,1-2H3
InChIKeyYAKZQHHDOOBECB-UHFFFAOYSA-N
XLogP1.68
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-[(4-ethylmorpholin-2-yl)methoxy]-4-methylaniline
CID 79166695
[3-[(4-ethylmorpholin-2-yl)methoxy]phenyl]methanamine
CID 79166497
3-[(4-ethylmorpholin-2-yl)methoxy]phenol
CID 79171875
(1R)-1-[4-[(4-ethylmorpholin-2-yl)methoxy]-2-fluorophenyl]ethanamine
CID 107718195
4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine
CID 102990646
5-bromo-2-[(4-ethylmorpholin-2-yl)methoxy]aniline
CID 79167033
4-ethyl-2-[[4-(morpholin-4-ylmethyl)phenoxy]methyl]morpholine
CID 44581056
N-[[4-[(4-ethylmorpholin-2-yl)methoxy]phenyl]methyl]propan-1-amine
CID 79165728
1-[5-[(4-ethylmorpholin-2-yl)methoxy]-2-pyridinyl]propan-2-amine
CID 79800444
4-ethoxy-2-[(4-ethylmorpholin-2-yl)methylsulfanyl]aniline
CID 79527456
4-ethyl-2-[[4-(4-methoxyphenyl)-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]morpholine
CID 58696203
[2-[(4-ethylmorpholin-2-yl)methoxy]phenyl]methanamine
CID 79166316

Frequently Asked Questions

What is the IUPAC name of 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline?
The IUPAC name of 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline (CID 114252444) is 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline.
What is the SMILES notation for 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline?
The canonical SMILES for 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline is CCN1CCOC(COc2ccc(C)c(N)c2)C1.
What is the InChIKey of 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline?
The InChIKey is YAKZQHHDOOBECB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-16-6-7-17-13(9-16)10-18-12-5-4-11(2)14(15)8-12/h4-5,8,13H,3,6-7,9-10,15H2,1-2H3.
What are the key properties of 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline?
5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline has a molecular weight of 250.34 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline is sourced from PubChem (CID 114252444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).