N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide

C10H20N2O2 — CID 116654558

IUPACN-ethyl-N,3,3-trimethylmorpholine-4-carboxamide
SMILESCCN(C)C(=O)N1CCOCC1(C)C
InChIInChI=1S/C10H20N2O2/c1-5-11(4)9(13)12-6-7-14-8-10(12,2)3/h5-8H2,1-4H3
InChIKeyXFRRWZBWDNCQIO-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.17
Rot. Bonds1

About N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide

N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide (PubChem CID 116654558) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N,3,3-trimethylmorpholine-4-carboxamide
PubChem CID116654558
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-ethyl-N,3,3-trimethylmorpholine-4-carboxamide
SMILESCCN(C)C(=O)N1CCOCC1(C)C
InChIInChI=1S/C10H20N2O2/c1-5-11(4)9(13)12-6-7-14-8-10(12,2)3/h5-8H2,1-4H3
InChIKeyXFRRWZBWDNCQIO-UHFFFAOYSA-N
XLogP1.17
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-(3,3-dimethylmorpholin-4-yl)-2-hydroxypropan-1-one
CID 126987422
1-(3,3-dimethylmorpholin-4-yl)-2-ethylsulfonylethanone
CID 48521830
(2R)-2-amino-1-(3,3-dimethylmorpholin-4-yl)propan-1-one
CID 78973108
2-amino-1-(3,3-dimethylmorpholin-4-yl)-2-ethylbutan-1-one
CID 79813841
(2S)-2-amino-1-(3,3-dimethylmorpholin-4-yl)butan-1-one
CID 79022791
2-[(3,3-dimethylmorpholine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid
CID 79271152
2-amino-1-(3,3-dimethylmorpholin-4-yl)-4-methylpentan-1-one
CID 61430745
1-(3,3-dimethylmorpholin-4-yl)-2-methoxypropan-1-one
CID 48521768
1-(3,3-dimethylmorpholine-4-carbonyl)-4-ethylpiperidine-4-carboxylic acid
CID 63127056
(3,3-dimethylmorpholin-4-yl)-piperidin-1-ylmethanone
CID 115592934
(3,3-dimethylmorpholin-4-yl)-[4-(ethylamino)-3,5-difluorophenyl]methanone
CID 63186014
N'-ethyl-3,3-dimethylmorpholine-4-carboximidamide
CID 62362564

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide?
The IUPAC name of N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide (CID 116654558) is N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide.
What is the SMILES notation for N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide?
The canonical SMILES for N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide is CCN(C)C(=O)N1CCOCC1(C)C.
What is the InChIKey of N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide?
The InChIKey is XFRRWZBWDNCQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-5-11(4)9(13)12-6-7-14-8-10(12,2)3/h5-8H2,1-4H3.
What are the key properties of N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide?
N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 1.17, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,3,3-trimethylmorpholine-4-carboxamide is sourced from PubChem (CID 116654558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).