N-methyl-4-morpholin-4-ylbut-2-enamide

C9H16N2O2 — CID 90934909

IUPACN-methyl-4-morpholin-4-ylbut-2-enamide
SMILESCNC(=O)C=CCN1CCOCC1
InChIInChI=1S/C9H16N2O2/c1-10-9(12)3-2-4-11-5-7-13-8-6-11/h2-3H,4-8H2,1H3,(H,10,12)
InChIKeyGNDDNPLOIDNSCL-UHFFFAOYSA-N
MW184.24 g/mol
LogP-0.38
Rot. Bonds3

About N-methyl-4-morpholin-4-ylbut-2-enamide

N-methyl-4-morpholin-4-ylbut-2-enamide (PubChem CID 90934909) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-methyl-4-morpholin-4-ylbut-2-enamide.

Molecular Properties

Compound NameN-methyl-4-morpholin-4-ylbut-2-enamide
PubChem CID90934909
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-methyl-4-morpholin-4-ylbut-2-enamide
SMILESCNC(=O)C=CCN1CCOCC1
InChIInChI=1S/C9H16N2O2/c1-10-9(12)3-2-4-11-5-7-13-8-6-11/h2-3H,4-8H2,1H3,(H,10,12)
InChIKeyGNDDNPLOIDNSCL-UHFFFAOYSA-N
XLogP-0.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.38
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

(E)-N-methyl-4-morpholin-4-ylbut-2-enamide
CID 89242760
Morpholine, 4-(1-oxo-2-butenyl)-
CID 5463262
N-(2-hydroxyethyl)prop-2-enamide;1-morpholin-4-ylprop-2-en-1-one
CID 69898105
4-Fluoro-4-morpholin-4-ylbut-2-enamide
CID 174765550
1-Morpholin-4-ylbut-2-en-1-one
CID 142893
N-(2-Morpholinoethyl)acrylamide
CID 10241489
N-(3-Morpholinopropyl)acrylamide
CID 11735756
(E)-4-morpholin-4-ylbut-2-enamide
CID 17897632
(E)-4-[2-methoxyethyl(methyl)amino]but-2-enamide
CID 17903637
N-(1-morpholin-4-ylethyl)prop-2-enamide
CID 18539662
N-[2-[2-(dimethylamino)ethoxy]ethyl]prop-2-enamide
CID 20310793
Morpholine;prop-2-enamide
CID 23282009

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-morpholin-4-ylbut-2-enamide?
The IUPAC name of N-methyl-4-morpholin-4-ylbut-2-enamide (CID 90934909) is N-methyl-4-morpholin-4-ylbut-2-enamide.
What is the SMILES notation for N-methyl-4-morpholin-4-ylbut-2-enamide?
The canonical SMILES for N-methyl-4-morpholin-4-ylbut-2-enamide is CNC(=O)C=CCN1CCOCC1.
What is the InChIKey of N-methyl-4-morpholin-4-ylbut-2-enamide?
The InChIKey is GNDDNPLOIDNSCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-10-9(12)3-2-4-11-5-7-13-8-6-11/h2-3H,4-8H2,1H3,(H,10,12).
What are the key properties of N-methyl-4-morpholin-4-ylbut-2-enamide?
N-methyl-4-morpholin-4-ylbut-2-enamide has a molecular weight of 184.24 g/mol, XLogP of -0.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-morpholin-4-ylbut-2-enamide is sourced from PubChem (CID 90934909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).