3,5-diethyl-N-methylmorpholine-4-carboxamide

C10H20N2O2 — CID 129281645

IUPAC3,5-diethyl-N-methylmorpholine-4-carboxamide
SMILESCCC1COCC(CC)N1C(=O)NC
InChIInChI=1S/C10H20N2O2/c1-4-8-6-14-7-9(5-2)12(8)10(13)11-3/h8-9H,4-7H2,1-3H3,(H,11,13)
InChIKeyLIDJELCJMQCXBK-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.22
Rot. Bonds2

About 3,5-diethyl-N-methylmorpholine-4-carboxamide

3,5-diethyl-N-methylmorpholine-4-carboxamide (PubChem CID 129281645) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3,5-diethyl-N-methylmorpholine-4-carboxamide.

Molecular Properties

Compound Name3,5-diethyl-N-methylmorpholine-4-carboxamide
PubChem CID129281645
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3,5-diethyl-N-methylmorpholine-4-carboxamide
SMILESCCC1COCC(CC)N1C(=O)NC
InChIInChI=1S/C10H20N2O2/c1-4-8-6-14-7-9(5-2)12(8)10(13)11-3/h8-9H,4-7H2,1-3H3,(H,11,13)
InChIKeyLIDJELCJMQCXBK-UHFFFAOYSA-N
XLogP1.22
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-N-methylmorpholine-4-carboxamide?
The IUPAC name of 3,5-diethyl-N-methylmorpholine-4-carboxamide (CID 129281645) is 3,5-diethyl-N-methylmorpholine-4-carboxamide.
What is the SMILES notation for 3,5-diethyl-N-methylmorpholine-4-carboxamide?
The canonical SMILES for 3,5-diethyl-N-methylmorpholine-4-carboxamide is CCC1COCC(CC)N1C(=O)NC.
What is the InChIKey of 3,5-diethyl-N-methylmorpholine-4-carboxamide?
The InChIKey is LIDJELCJMQCXBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-4-8-6-14-7-9(5-2)12(8)10(13)11-3/h8-9H,4-7H2,1-3H3,(H,11,13).
What are the key properties of 3,5-diethyl-N-methylmorpholine-4-carboxamide?
3,5-diethyl-N-methylmorpholine-4-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-N-methylmorpholine-4-carboxamide is sourced from PubChem (CID 129281645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).