2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide

C12H24N2O2 — CID 42954982

IUPAC2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide
SMILESCCC1CN(CC(=O)NCC(C)C)CCO1
InChIInChI=1S/C12H24N2O2/c1-4-11-8-14(5-6-16-11)9-12(15)13-7-10(2)3/h10-11H,4-9H2,1-3H3,(H,13,15)
InChIKeyUTPSHZSDMUSXIS-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.87
Rot. Bonds5

About 2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide

2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide (PubChem CID 42954982) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide
PubChem CID42954982
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide
SMILESCCC1CN(CC(=O)NCC(C)C)CCO1
InChIInChI=1S/C12H24N2O2/c1-4-11-8-14(5-6-16-11)9-12(15)13-7-10(2)3/h10-11H,4-9H2,1-3H3,(H,13,15)
InChIKeyUTPSHZSDMUSXIS-UHFFFAOYSA-N
XLogP0.87
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.87
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)-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide (CID 42954982) is 2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide is CCC1CN(CC(=O)NCC(C)C)CCO1.
What is the InChIKey of 2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide?
The InChIKey is UTPSHZSDMUSXIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-11-8-14(5-6-16-11)9-12(15)13-7-10(2)3/h10-11H,4-9H2,1-3H3,(H,13,15).
What are the key properties of 2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide?
2-(2-ethylmorpholin-4-yl)-N-(2-methylpropyl)acetamide has a molecular weight of 228.34 g/mol, XLogP of 0.87, 5 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)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 42954982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).