N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide

C10H18N2O2 — CID 156693084

IUPACN-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide
SMILESC=CC(=O)NCN1CCOC(CC)C1
InChIInChI=1S/C10H18N2O2/c1-3-9-7-12(5-6-14-9)8-11-10(13)4-2/h4,9H,2-3,5-8H2,1H3,(H,11,13)
InChIKeyPUDPHJKMUHJAPO-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.36
Rot. Bonds4

About N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide

N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide (PubChem CID 156693084) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide.

Molecular Properties

Compound NameN-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide
PubChem CID156693084
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide
SMILESC=CC(=O)NCN1CCOC(CC)C1
InChIInChI=1S/C10H18N2O2/c1-3-9-7-12(5-6-14-9)8-11-10(13)4-2/h4,9H,2-3,5-8H2,1H3,(H,11,13)
InChIKeyPUDPHJKMUHJAPO-UHFFFAOYSA-N
XLogP0.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.36
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

N-[(Morpholin-4-yl)methyl]prop-2-enamide
CID 22725837
N-morpholinomethylacrylamide hydrochloride
CID 129761885
N-(1-morpholin-4-ylethyl)prop-2-enamide
CID 18539662
Dimethyl-[oxiran-2-yl-(prop-2-enoylamino)methyl]-propylazanium chloride
CID 19707560
N-[1-(3,5-dimethylmorpholin-4-yl)ethyl]prop-2-enamide
CID 19872356
N-[4-(1-morpholin-4-ylpropan-2-yloxy)butyl]prop-2-enamide
CID 20214393
2-methyl-N-(1-morpholin-4-ylpropyl)prop-2-enamide
CID 23205772
N-(4-morpholin-4-ylbutyl)prop-2-enamide
CID 54322258
N-2-Morpholinylethylacrylamide
CID 54481936
N-(4-propylmorpholin-3-yl)prop-2-enamide
CID 66614706
2-methyl-N-(1-morpholin-4-ylethyl)prop-2-enamide
CID 66895954
N-(4-ethyl-4-methylmorpholin-4-ium-3-yl)-2-methylprop-2-enamide
CID 67519605

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide?
The IUPAC name of N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide (CID 156693084) is N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide.
What is the SMILES notation for N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide?
The canonical SMILES for N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide is C=CC(=O)NCN1CCOC(CC)C1.
What is the InChIKey of N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide?
The InChIKey is PUDPHJKMUHJAPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-3-9-7-12(5-6-14-9)8-11-10(13)4-2/h4,9H,2-3,5-8H2,1H3,(H,11,13).
What are the key properties of N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide?
N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide has a molecular weight of 198.27 g/mol, XLogP of 0.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylmorpholin-4-yl)methyl]prop-2-enamide is sourced from PubChem (CID 156693084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).