2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline

C14H22N2O2 — CID 43544167

IUPAC2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline
SMILESCC1CN(CCOc2ccccc2N)C(C)CO1
InChIInChI=1S/C14H22N2O2/c1-11-10-18-12(2)9-16(11)7-8-17-14-6-4-3-5-13(14)15/h3-6,11-12H,7-10,15H2,1-2H3
InChIKeyRKQGJWLKLRTPHW-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.76
Rot. Bonds4

About 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline

2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline (PubChem CID 43544167) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline.

Molecular Properties

Compound Name2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline
PubChem CID43544167
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline
SMILESCC1CN(CCOc2ccccc2N)C(C)CO1
InChIInChI=1S/C14H22N2O2/c1-11-10-18-12(2)9-16(11)7-8-17-14-6-4-3-5-13(14)15/h3-6,11-12H,7-10,15H2,1-2H3
InChIKeyRKQGJWLKLRTPHW-UHFFFAOYSA-N
XLogP1.76
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 ≤ 51.76
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

2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone
CID 43544132
2-[2-(2,3,5-trimethylpiperidin-1-yl)ethoxy]aniline
CID 114592202
2-[3-(2-methyl-1,4-oxazepan-4-yl)propoxy]aniline
CID 62987901
[3-[3-(2,5-dimethylmorpholin-4-yl)propoxy]phenyl]methanamine
CID 43544254
2-[2-(3,4-dimethoxypyrrolidin-1-yl)ethoxy]aniline
CID 103531079
2-[2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)ethoxy]aniline
CID 65319312
4-(2,5-dimethylmorpholin-4-yl)-2-propoxyaniline
CID 63671664
2-[2-(2-ethylmorpholin-4-yl)ethoxy]aniline
CID 43562249
2-[3-(3,5-dimethylpiperidin-1-yl)propoxy]aniline
CID 43174256
2-[2-(2-ethylpyrrolidin-1-yl)ethoxy]aniline
CID 60973851
N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-2-methylaniline
CID 62560224
2-[2-(2,5-dimethylmorpholin-4-yl)ethyl]cyclopentan-1-amine
CID 79569935

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline?
The IUPAC name of 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline (CID 43544167) is 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline.
What is the SMILES notation for 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline?
The canonical SMILES for 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline is CC1CN(CCOc2ccccc2N)C(C)CO1.
What is the InChIKey of 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline?
The InChIKey is RKQGJWLKLRTPHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11-10-18-12(2)9-16(11)7-8-17-14-6-4-3-5-13(14)15/h3-6,11-12H,7-10,15H2,1-2H3.
What are the key properties of 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline?
2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline has a molecular weight of 250.34 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline is sourced from PubChem (CID 43544167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).