2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline

C14H22N2O2 — CID 55234148

IUPAC2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline
SMILESCCOc1cc(N2CCOCC2CC)ccc1N
InChIInChI=1S/C14H22N2O2/c1-3-11-10-17-8-7-16(11)12-5-6-13(15)14(9-12)18-4-2/h5-6,9,11H,3-4,7-8,10,15H2,1-2H3
InChIKeyFURWRRIPNOSUGM-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.28
Rot. Bonds4

About 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline

2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline (PubChem CID 55234148) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline.

Molecular Properties

Compound Name2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline
PubChem CID55234148
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline
SMILESCCOc1cc(N2CCOCC2CC)ccc1N
InChIInChI=1S/C14H22N2O2/c1-3-11-10-17-8-7-16(11)12-5-6-13(15)14(9-12)18-4-2/h5-6,9,11H,3-4,7-8,10,15H2,1-2H3
InChIKeyFURWRRIPNOSUGM-UHFFFAOYSA-N
XLogP2.28
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 ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline?
The IUPAC name of 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline (CID 55234148) is 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline.
What is the SMILES notation for 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline?
The canonical SMILES for 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline is CCOc1cc(N2CCOCC2CC)ccc1N.
What is the InChIKey of 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline?
The InChIKey is FURWRRIPNOSUGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-11-10-17-8-7-16(11)12-5-6-13(15)14(9-12)18-4-2/h5-6,9,11H,3-4,7-8,10,15H2,1-2H3.
What are the key properties of 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline?
2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline has a molecular weight of 250.34 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4-(3-ethylmorpholin-4-yl)aniline is sourced from PubChem (CID 55234148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).