4-(3-azidopropyl)-5-ethyl-2-methylmorpholine

C10H20N4O — CID 61424062

IUPAC4-(3-azidopropyl)-5-ethyl-2-methylmorpholine
SMILESCCC1COC(C)CN1CCCN=[N+]=[N-]
InChIInChI=1S/C10H20N4O/c1-3-10-8-15-9(2)7-14(10)6-4-5-12-13-11/h9-10H,3-8H2,1-2H3
InChIKeyOEKUXPZQSLJROK-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.19
Rot. Bonds5

About 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine

4-(3-azidopropyl)-5-ethyl-2-methylmorpholine (PubChem CID 61424062) has the molecular formula C10H20N4O and a molecular weight of 212.30 g/mol. Its IUPAC name is 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine.

Molecular Properties

Compound Name4-(3-azidopropyl)-5-ethyl-2-methylmorpholine
PubChem CID61424062
Molecular FormulaC10H20N4O
Molecular Weight212.30 g/mol
Exact Mass212.16
IUPAC Name4-(3-azidopropyl)-5-ethyl-2-methylmorpholine
SMILESCCC1COC(C)CN1CCCN=[N+]=[N-]
InChIInChI=1S/C10H20N4O/c1-3-10-8-15-9(2)7-14(10)6-4-5-12-13-11/h9-10H,3-8H2,1-2H3
InChIKeyOEKUXPZQSLJROK-UHFFFAOYSA-N
XLogP2.19
TPSA61.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

3-(5-ethyl-2-methylmorpholin-4-yl)propan-1-ol
CID 60692406
5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol
CID 62229159
5-ethyl-4-(2-fluoroethyl)-2-methylmorpholine
CID 130685633
5-(5-ethyl-2-methylmorpholin-4-yl)-2-methylpentan-1-amine
CID 82683901
3-(5-ethyl-2-methylmorpholin-4-yl)propane-1-sulfonyl chloride
CID 112594679
4-[3-(5-ethyl-2-methylmorpholin-4-yl)propoxy]aniline
CID 43575089
2-[3-(5-ethyl-2-methylmorpholin-4-yl)propyl]aniline
CID 107274350
N-tert-butyl-5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-amine
CID 62462120
5-(5-ethyl-2-methylmorpholin-4-yl)-N'-hydroxy-2,2-dimethylpentanimidamide
CID 77063744
5-ethyl-2-methyl-4-(oxiran-2-ylmethyl)morpholine
CID 61424186
4-[2-(azetidin-3-yl)ethyl]-5-ethyl-2-methylmorpholine
CID 116679610
[4-(3-azidopropyl)-5-methylmorpholin-2-yl]methanol
CID 81219212

Frequently Asked Questions

What is the IUPAC name of 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine?
The IUPAC name of 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine (CID 61424062) is 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine.
What is the SMILES notation for 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine?
The canonical SMILES for 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine is CCC1COC(C)CN1CCCN=[N+]=[N-].
What is the InChIKey of 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine?
The InChIKey is OEKUXPZQSLJROK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O/c1-3-10-8-15-9(2)7-14(10)6-4-5-12-13-11/h9-10H,3-8H2,1-2H3.
What are the key properties of 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine?
4-(3-azidopropyl)-5-ethyl-2-methylmorpholine has a molecular weight of 212.30 g/mol, XLogP of 2.19, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-azidopropyl)-5-ethyl-2-methylmorpholine is sourced from PubChem (CID 61424062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).