4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline

C15H24N2O2 — CID 83001872

IUPAC4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline
SMILESCCC1COCCN1c1ccc(N)c(OC(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-4-12-10-18-8-7-17(12)13-5-6-14(16)15(9-13)19-11(2)3/h5-6,9,11-12H,4,7-8,10,16H2,1-3H3
InChIKeyUGMXMAPSTSHAJA-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.67
Rot. Bonds4

About 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline

4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline (PubChem CID 83001872) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline.

Molecular Properties

Compound Name4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline
PubChem CID83001872
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline
SMILESCCC1COCCN1c1ccc(N)c(OC(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-4-12-10-18-8-7-17(12)13-5-6-14(16)15(9-13)19-11(2)3/h5-6,9,11-12H,4,7-8,10,16H2,1-3H3
InChIKeyUGMXMAPSTSHAJA-UHFFFAOYSA-N
XLogP2.67
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.67
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 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline?
The IUPAC name of 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline (CID 83001872) is 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline.
What is the SMILES notation for 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline?
The canonical SMILES for 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline is CCC1COCCN1c1ccc(N)c(OC(C)C)c1.
What is the InChIKey of 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline?
The InChIKey is UGMXMAPSTSHAJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-12-10-18-8-7-17(12)13-5-6-14(16)15(9-13)19-11(2)3/h5-6,9,11-12H,4,7-8,10,16H2,1-3H3.
What are the key properties of 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline?
4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline has a molecular weight of 264.37 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethylmorpholin-4-yl)-2-propan-2-yloxyaniline is sourced from PubChem (CID 83001872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).