3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline

C15H24N2O2 — CID 43562250

IUPAC3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline
SMILESCCC1CN(CCCOc2cccc(N)c2)CCO1
InChIInChI=1S/C15H24N2O2/c1-2-14-12-17(8-10-19-14)7-4-9-18-15-6-3-5-13(16)11-15/h3,5-6,11,14H,2,4,7-10,12,16H2,1H3
InChIKeyPXFOXBDHZCOANB-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.15
Rot. Bonds6

About 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline

3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline (PubChem CID 43562250) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline.

Molecular Properties

Compound Name3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline
PubChem CID43562250
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline
SMILESCCC1CN(CCCOc2cccc(N)c2)CCO1
InChIInChI=1S/C15H24N2O2/c1-2-14-12-17(8-10-19-14)7-4-9-18-15-6-3-5-13(16)11-15/h3,5-6,11,14H,2,4,7-10,12,16H2,1H3
InChIKeyPXFOXBDHZCOANB-UHFFFAOYSA-N
XLogP2.15
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[4-[3-(3-aminophenoxy)propyl]morpholin-2-yl]methanol
CID 81205796
3-[3-(2,6-dimethylmorpholin-4-yl)propoxy]aniline
CID 43365509
[4-[3-[3-(aminomethyl)phenoxy]propyl]morpholin-2-yl]methanol
CID 81203703
[4-[2-(2-ethylmorpholin-4-yl)ethoxy]phenyl]methanamine
CID 43562361
2-[2-(2-ethylmorpholin-4-yl)ethoxy]aniline
CID 43562249
3-[3-(1,3-dihydroisoindol-2-yl)propoxy]aniline
CID 62204800
3-[2-(4-propylpiperazin-1-yl)ethoxy]aniline
CID 43174249
3-[3-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)propoxy]aniline
CID 82364127
(2R)-2-[(3-bromophenoxy)methyl]-4-propylmorpholine
CID 99979834
3-[3-(5-methoxy-1,3-dihydroisoindol-2-yl)propoxy]aniline
CID 82164143
3-[3-(3,3-dimethylmorpholin-4-yl)propoxy]aniline
CID 61429455
3-(2-ethylmorpholin-4-yl)sulfonylaniline
CID 43562350

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline?
The IUPAC name of 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline (CID 43562250) is 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline.
What is the SMILES notation for 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline?
The canonical SMILES for 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline is CCC1CN(CCCOc2cccc(N)c2)CCO1.
What is the InChIKey of 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline?
The InChIKey is PXFOXBDHZCOANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-2-14-12-17(8-10-19-14)7-4-9-18-15-6-3-5-13(16)11-15/h3,5-6,11,14H,2,4,7-10,12,16H2,1H3.
What are the key properties of 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline?
3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline has a molecular weight of 264.37 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-ethylmorpholin-4-yl)propoxy]aniline is sourced from PubChem (CID 43562250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).