1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine

C15H32N2O — CID 62625316

IUPAC1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine
SMILESCCNC(CCN1CC(C)OCC1C)C(C)(C)C
InChIInChI=1S/C15H32N2O/c1-7-16-14(15(4,5)6)8-9-17-10-13(3)18-11-12(17)2/h12-14,16H,7-11H2,1-6H3
InChIKeyXMLXZXRAJOWVDT-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.51
Rot. Bonds5

About 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine

1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine (PubChem CID 62625316) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine.

Molecular Properties

Compound Name1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine
PubChem CID62625316
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine
SMILESCCNC(CCN1CC(C)OCC1C)C(C)(C)C
InChIInChI=1S/C15H32N2O/c1-7-16-14(15(4,5)6)8-9-17-10-13(3)18-11-12(17)2/h12-14,16H,7-11H2,1-6H3
InChIKeyXMLXZXRAJOWVDT-UHFFFAOYSA-N
XLogP2.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine?
The IUPAC name of 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine (CID 62625316) is 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine.
What is the SMILES notation for 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine?
The canonical SMILES for 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine is CCNC(CCN1CC(C)OCC1C)C(C)(C)C.
What is the InChIKey of 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine?
The InChIKey is XMLXZXRAJOWVDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-7-16-14(15(4,5)6)8-9-17-10-13(3)18-11-12(17)2/h12-14,16H,7-11H2,1-6H3.
What are the key properties of 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine?
1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine has a molecular weight of 256.43 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine is sourced from PubChem (CID 62625316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).