2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine

C12H26N2O — CID 61353367

IUPAC2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine
SMILESCCC1CN(C(C)(CN)C(C)C)CCO1
InChIInChI=1S/C12H26N2O/c1-5-11-8-14(6-7-15-11)12(4,9-13)10(2)3/h10-11H,5-9,13H2,1-4H3
InChIKeyDYNQHJLZTXCKNV-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.47
Rot. Bonds4

About 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine

2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine (PubChem CID 61353367) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine.

Molecular Properties

Compound Name2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine
PubChem CID61353367
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine
SMILESCCC1CN(C(C)(CN)C(C)C)CCO1
InChIInChI=1S/C12H26N2O/c1-5-11-8-14(6-7-15-11)12(4,9-13)10(2)3/h10-11H,5-9,13H2,1-4H3
InChIKeyDYNQHJLZTXCKNV-UHFFFAOYSA-N
XLogP1.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine?
The IUPAC name of 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine (CID 61353367) is 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine.
What is the SMILES notation for 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine?
The canonical SMILES for 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine is CCC1CN(C(C)(CN)C(C)C)CCO1.
What is the InChIKey of 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine?
The InChIKey is DYNQHJLZTXCKNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-5-11-8-14(6-7-15-11)12(4,9-13)10(2)3/h10-11H,5-9,13H2,1-4H3.
What are the key properties of 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine?
2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylmorpholin-4-yl)-2,3-dimethylbutan-1-amine is sourced from PubChem (CID 61353367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).