4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one

C14H28N2O2 — CID 166717167

IUPAC4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one
SMILESCCN(CC)C(C)C(C)CC(=O)N1CCOCC1
InChIInChI=1S/C14H28N2O2/c1-5-15(6-2)13(4)12(3)11-14(17)16-7-9-18-10-8-16/h12-13H,5-11H2,1-4H3
InChIKeyHYOXORNBGLMEAW-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.60
Rot. Bonds6

About 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one

4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one (PubChem CID 166717167) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one.

Molecular Properties

Compound Name4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one
PubChem CID166717167
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one
SMILESCCN(CC)C(C)C(C)CC(=O)N1CCOCC1
InChIInChI=1S/C14H28N2O2/c1-5-15(6-2)13(4)12(3)11-14(17)16-7-9-18-10-8-16/h12-13H,5-11H2,1-4H3
InChIKeyHYOXORNBGLMEAW-UHFFFAOYSA-N
XLogP1.60
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one?
The IUPAC name of 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one (CID 166717167) is 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one.
What is the SMILES notation for 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one?
The canonical SMILES for 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one is CCN(CC)C(C)C(C)CC(=O)N1CCOCC1.
What is the InChIKey of 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one?
The InChIKey is HYOXORNBGLMEAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-5-15(6-2)13(4)12(3)11-14(17)16-7-9-18-10-8-16/h12-13H,5-11H2,1-4H3.
What are the key properties of 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one?
4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one has a molecular weight of 256.39 g/mol, XLogP of 1.60, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylamino)-3-methyl-1-morpholin-4-ylpentan-1-one is sourced from PubChem (CID 166717167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).