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

C9H18N2O2 — CID 116653749

IUPACN-ethyl-N,2-dimethylmorpholine-4-carboxamide
SMILESCCN(C)C(=O)N1CCOC(C)C1
InChIInChI=1S/C9H18N2O2/c1-4-10(3)9(12)11-5-6-13-8(2)7-11/h8H,4-7H2,1-3H3
InChIKeyKBLVNUIWAVETRY-UHFFFAOYSA-N
MW186.25 g/mol
LogP0.78
Rot. Bonds1

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

N-ethyl-N,2-dimethylmorpholine-4-carboxamide (PubChem CID 116653749) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-ethyl-N,2-dimethylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N,2-dimethylmorpholine-4-carboxamide
PubChem CID116653749
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-ethyl-N,2-dimethylmorpholine-4-carboxamide
SMILESCCN(C)C(=O)N1CCOC(C)C1
InChIInChI=1S/C9H18N2O2/c1-4-10(3)9(12)11-5-6-13-8(2)7-11/h8H,4-7H2,1-3H3
InChIKeyKBLVNUIWAVETRY-UHFFFAOYSA-N
XLogP0.78
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-carbamothioyl-N-ethyl-N-methylmorpholine-4-carboxamide
CID 79675024
2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-ethyl-N-methylacetamide;hydroiodide
CID 120662161
2-methyl-3-[methyl-(2-methyl-1,4-oxazepane-4-carbonyl)amino]propanoic acid
CID 55140571
(2S)-2-methylmorpholine-4-carbonyl chloride
CID 151798222
1-[ethyl(methyl)carbamoyl]piperidine-3,4-dicarboxylic acid
CID 112568039
2-[1-[methyl-(2-methylmorpholine-4-carbonyl)amino]cyclohexyl]acetic acid
CID 65240993
2-chloro-1-(2-methylmorpholin-4-yl)propan-1-one
CID 24698951
3-amino-N-ethyl-N-methylpyrrolidine-1-carboxamide
CID 79162356
ethyl 2-(2-methylmorpholin-4-yl)-2-oxoacetate
CID 60893749
2-methylmorpholine-4-carboperoxoic acid
CID 175134730
2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-1-(2-methylmorpholin-4-yl)ethanone
CID 78963901
4-[(2-methylmorpholine-4-carbonyl)-propan-2-ylamino]butanoic acid
CID 61189226

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,2-dimethylmorpholine-4-carboxamide?
The IUPAC name of N-ethyl-N,2-dimethylmorpholine-4-carboxamide (CID 116653749) is N-ethyl-N,2-dimethylmorpholine-4-carboxamide.
What is the SMILES notation for N-ethyl-N,2-dimethylmorpholine-4-carboxamide?
The canonical SMILES for N-ethyl-N,2-dimethylmorpholine-4-carboxamide is CCN(C)C(=O)N1CCOC(C)C1.
What is the InChIKey of N-ethyl-N,2-dimethylmorpholine-4-carboxamide?
The InChIKey is KBLVNUIWAVETRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-4-10(3)9(12)11-5-6-13-8(2)7-11/h8H,4-7H2,1-3H3.
What are the key properties of N-ethyl-N,2-dimethylmorpholine-4-carboxamide?
N-ethyl-N,2-dimethylmorpholine-4-carboxamide has a molecular weight of 186.25 g/mol, XLogP of 0.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,2-dimethylmorpholine-4-carboxamide is sourced from PubChem (CID 116653749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).