N-ethyl-2,6-dimethylmorpholine-4-carboxamide

C9H18N2O2 — CID 89128876

IUPACN-ethyl-2,6-dimethylmorpholine-4-carboxamide
SMILESCCNC(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C9H18N2O2/c1-4-10-9(12)11-5-7(2)13-8(3)6-11/h7-8H,4-6H2,1-3H3,(H,10,12)
InChIKeyBHCJSBKEKXXSFV-UHFFFAOYSA-N
MW186.25 g/mol
LogP0.83
Rot. Bonds1

About N-ethyl-2,6-dimethylmorpholine-4-carboxamide

N-ethyl-2,6-dimethylmorpholine-4-carboxamide (PubChem CID 89128876) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-ethyl-2,6-dimethylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-2,6-dimethylmorpholine-4-carboxamide
PubChem CID89128876
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-ethyl-2,6-dimethylmorpholine-4-carboxamide
SMILESCCNC(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C9H18N2O2/c1-4-10-9(12)11-5-7(2)13-8(3)6-11/h7-8H,4-6H2,1-3H3,(H,10,12)
InChIKeyBHCJSBKEKXXSFV-UHFFFAOYSA-N
XLogP0.83
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,6-dimethylmorpholine-4-carboxamide?
The IUPAC name of N-ethyl-2,6-dimethylmorpholine-4-carboxamide (CID 89128876) is N-ethyl-2,6-dimethylmorpholine-4-carboxamide.
What is the SMILES notation for N-ethyl-2,6-dimethylmorpholine-4-carboxamide?
The canonical SMILES for N-ethyl-2,6-dimethylmorpholine-4-carboxamide is CCNC(=O)N1CC(C)OC(C)C1.
What is the InChIKey of N-ethyl-2,6-dimethylmorpholine-4-carboxamide?
The InChIKey is BHCJSBKEKXXSFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-4-10-9(12)11-5-7(2)13-8(3)6-11/h7-8H,4-6H2,1-3H3,(H,10,12).
What are the key properties of N-ethyl-2,6-dimethylmorpholine-4-carboxamide?
N-ethyl-2,6-dimethylmorpholine-4-carboxamide has a molecular weight of 186.25 g/mol, XLogP of 0.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,6-dimethylmorpholine-4-carboxamide is sourced from PubChem (CID 89128876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).