4-(2-iodoethyl)-2,5-dimethylmorpholine

C8H16INO — CID 130977867

IUPAC4-(2-iodoethyl)-2,5-dimethylmorpholine
SMILESCC1CN(CCI)C(C)CO1
InChIInChI=1S/C8H16INO/c1-7-6-11-8(2)5-10(7)4-3-9/h7-8H,3-6H2,1-2H3
InChIKeyQGLJFRCFCRVWGB-UHFFFAOYSA-N
MW269.13 g/mol
LogP1.53
Rot. Bonds2

About 4-(2-iodoethyl)-2,5-dimethylmorpholine

4-(2-iodoethyl)-2,5-dimethylmorpholine (PubChem CID 130977867) has the molecular formula C8H16INO and a molecular weight of 269.13 g/mol. Its IUPAC name is 4-(2-iodoethyl)-2,5-dimethylmorpholine.

Molecular Properties

Compound Name4-(2-iodoethyl)-2,5-dimethylmorpholine
PubChem CID130977867
Molecular FormulaC8H16INO
Molecular Weight269.13 g/mol
Exact Mass269.03
IUPAC Name4-(2-iodoethyl)-2,5-dimethylmorpholine
SMILESCC1CN(CCI)C(C)CO1
InChIInChI=1S/C8H16INO/c1-7-6-11-8(2)5-10(7)4-3-9/h7-8H,3-6H2,1-2H3
InChIKeyQGLJFRCFCRVWGB-UHFFFAOYSA-N
XLogP1.53
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.13
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(2,5-dimethylmorpholin-4-yl)propan-1-ol
CID 43430768
3-[(2S,5S)-2,5-dimethylmorpholin-4-yl]propanenitrile
CID 45088973
3-(2,5-dimethylmorpholin-4-yl)propanethioamide
CID 43544623
N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]cyclopropanamine
CID 60841046
1-(2,5-dimethylmorpholin-4-yl)-4,4-dimethylpentan-3-ol
CID 62624456
2-amino-4-(2,5-dimethylmorpholin-4-yl)butanamide
CID 63029627
1-[2-(2,5-dimethylmorpholin-4-yl)ethyl]piperidin-4-amine
CID 79327606
2-[2-(2,5-dimethylmorpholin-4-yl)ethyl]cyclopentan-1-amine
CID 79569935
2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]acetonitrile
CID 93044958
(5S)-2,4,5-trimethylmorpholine
CID 89376200
methyl 4-(2,5-dimethylmorpholin-4-yl)butanoate
CID 43544788
1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine
CID 62625316

Frequently Asked Questions

What is the IUPAC name of 4-(2-iodoethyl)-2,5-dimethylmorpholine?
The IUPAC name of 4-(2-iodoethyl)-2,5-dimethylmorpholine (CID 130977867) is 4-(2-iodoethyl)-2,5-dimethylmorpholine.
What is the SMILES notation for 4-(2-iodoethyl)-2,5-dimethylmorpholine?
The canonical SMILES for 4-(2-iodoethyl)-2,5-dimethylmorpholine is CC1CN(CCI)C(C)CO1.
What is the InChIKey of 4-(2-iodoethyl)-2,5-dimethylmorpholine?
The InChIKey is QGLJFRCFCRVWGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16INO/c1-7-6-11-8(2)5-10(7)4-3-9/h7-8H,3-6H2,1-2H3.
What are the key properties of 4-(2-iodoethyl)-2,5-dimethylmorpholine?
4-(2-iodoethyl)-2,5-dimethylmorpholine has a molecular weight of 269.13 g/mol, XLogP of 1.53, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-iodoethyl)-2,5-dimethylmorpholine is sourced from PubChem (CID 130977867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).