2-(chloromethyl)-4-(2-methoxyethyl)morpholine

C8H16ClNO2 — CID 71380067

IUPAC2-(chloromethyl)-4-(2-methoxyethyl)morpholine
SMILESCOCCN1CCOC(CCl)C1
InChIInChI=1S/C8H16ClNO2/c1-11-4-2-10-3-5-12-8(6-9)7-10/h8H,2-7H2,1H3
InChIKeyXIOKBXMCLGTWRR-UHFFFAOYSA-N
MW193.67 g/mol
LogP0.57
Rot. Bonds4

About 2-(chloromethyl)-4-(2-methoxyethyl)morpholine

2-(chloromethyl)-4-(2-methoxyethyl)morpholine (PubChem CID 71380067) has the molecular formula C8H16ClNO2 and a molecular weight of 193.67 g/mol. Its IUPAC name is 2-(chloromethyl)-4-(2-methoxyethyl)morpholine.

Molecular Properties

Compound Name2-(chloromethyl)-4-(2-methoxyethyl)morpholine
PubChem CID71380067
Molecular FormulaC8H16ClNO2
Molecular Weight193.67 g/mol
Exact Mass193.09
IUPAC Name2-(chloromethyl)-4-(2-methoxyethyl)morpholine
SMILESCOCCN1CCOC(CCl)C1
InChIInChI=1S/C8H16ClNO2/c1-11-4-2-10-3-5-12-8(6-9)7-10/h8H,2-7H2,1H3
InChIKeyXIOKBXMCLGTWRR-UHFFFAOYSA-N
XLogP0.57
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.67
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(chloromethyl)-4-pentylmorpholine
CID 81213679
3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid
CID 117008804
2-(chloromethyl)-4-heptylmorpholine
CID 81213546
3-[2-(chloromethyl)morpholin-4-yl]-N,N-dimethylpropan-1-amine
CID 114526695
2-[4-[2-(2-methoxyethoxy)ethyl]morpholin-2-yl]acetic acid
CID 66434854
2-(chloromethyl)-4-(3-ethylsulfonylpropyl)morpholine
CID 81214049
2-(bromomethyl)-4-[3-(2-methoxyethoxy)propyl]morpholine
CID 103413126
2-(chloromethyl)-4-[2-(1-methylpyrazol-4-yl)ethyl]morpholine
CID 103015288
2-(chloromethyl)-4-(2-methoxyethyl)-5-methylmorpholine
CID 81210752
4-[2-(2-methoxyethoxy)ethyl]morpholine-2-carbonitrile
CID 79675052
2-(chloromethyl)-4-[2-(1-methylimidazol-2-yl)ethyl]morpholine
CID 114531807
4-(3-methoxypropyl)morpholine-2-carbonitrile
CID 112734096

Frequently Asked Questions

What is the IUPAC name of 2-(chloromethyl)-4-(2-methoxyethyl)morpholine?
The IUPAC name of 2-(chloromethyl)-4-(2-methoxyethyl)morpholine (CID 71380067) is 2-(chloromethyl)-4-(2-methoxyethyl)morpholine.
What is the SMILES notation for 2-(chloromethyl)-4-(2-methoxyethyl)morpholine?
The canonical SMILES for 2-(chloromethyl)-4-(2-methoxyethyl)morpholine is COCCN1CCOC(CCl)C1.
What is the InChIKey of 2-(chloromethyl)-4-(2-methoxyethyl)morpholine?
The InChIKey is XIOKBXMCLGTWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16ClNO2/c1-11-4-2-10-3-5-12-8(6-9)7-10/h8H,2-7H2,1H3.
What are the key properties of 2-(chloromethyl)-4-(2-methoxyethyl)morpholine?
2-(chloromethyl)-4-(2-methoxyethyl)morpholine has a molecular weight of 193.67 g/mol, XLogP of 0.57, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chloromethyl)-4-(2-methoxyethyl)morpholine is sourced from PubChem (CID 71380067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).