N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide

C9H16N2O2 — CID 23039338

IUPACN-(2,6-dimethylmorpholin-4-yl)prop-2-enamide
SMILESC=CC(=O)NN1CC(C)OC(C)C1
InChIInChI=1S/C9H16N2O2/c1-4-9(12)10-11-5-7(2)13-8(3)6-11/h4,7-8H,1,5-6H2,2-3H3,(H,10,12)
InChIKeyPJSGJSAQVXMNLG-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.31
Rot. Bonds2

About N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide

N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide (PubChem CID 23039338) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide.

Molecular Properties

Compound NameN-(2,6-dimethylmorpholin-4-yl)prop-2-enamide
PubChem CID23039338
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-(2,6-dimethylmorpholin-4-yl)prop-2-enamide
SMILESC=CC(=O)NN1CC(C)OC(C)C1
InChIInChI=1S/C9H16N2O2/c1-4-9(12)10-11-5-7(2)13-8(3)6-11/h4,7-8H,1,5-6H2,2-3H3,(H,10,12)
InChIKeyPJSGJSAQVXMNLG-UHFFFAOYSA-N
XLogP0.31
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2,6-dimethyl-4-[(2E)-penta-2,4-dien-2-yl]morpholine;ethane
CID 143325399
N-imidazolidin-1-ylprop-2-enamide
CID 68795651
(2S,6S)-2,6-dimethylmorpholine-4-carboxylic acid
CID 137442866
2,6-dimethylmorpholine-4-carboxylic acid
CID 22047773
1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 3361054
2,6-dimethylmorpholine-4-carbonyl chloride
CID 19080228
N-[2,2,2-trichloro-1-(2,6-dimethylmorpholin-4-yl)ethyl]acetamide
CID 3103514
N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]prop-2-enamide
CID 125422227
1-[(2S,6R)-2-methyl-6-(trifluoromethyl)morpholin-4-yl]prop-2-en-1-one
CID 176677064
1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-methylbut-2-en-1-one
CID 52520989
N-(3-methyl-3-azabicyclo[3.1.0]hexan-6-yl)prop-2-enamide
CID 155732764
1-(2,6-dimethylmorpholin-4-yl)propane-1,2-dione
CID 131176238

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide?
The IUPAC name of N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide (CID 23039338) is N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide.
What is the SMILES notation for N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide?
The canonical SMILES for N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide is C=CC(=O)NN1CC(C)OC(C)C1.
What is the InChIKey of N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide?
The InChIKey is PJSGJSAQVXMNLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-4-9(12)10-11-5-7(2)13-8(3)6-11/h4,7-8H,1,5-6H2,2-3H3,(H,10,12).
What are the key properties of N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide?
N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide has a molecular weight of 184.24 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylmorpholin-4-yl)prop-2-enamide is sourced from PubChem (CID 23039338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).