2-methyl-3-morpholin-2-ylprop-2-enamide

C8H14N2O2 — CID 68744206

IUPAC2-methyl-3-morpholin-2-ylprop-2-enamide
SMILESCC(=CC1CNCCO1)C(N)=O
InChIInChI=1S/C8H14N2O2/c1-6(8(9)11)4-7-5-10-2-3-12-7/h4,7,10H,2-3,5H2,1H3,(H2,9,11)
InChIKeyYAJRXBRRLCUMTH-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.59
Rot. Bonds2

About 2-methyl-3-morpholin-2-ylprop-2-enamide

2-methyl-3-morpholin-2-ylprop-2-enamide (PubChem CID 68744206) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 2-methyl-3-morpholin-2-ylprop-2-enamide.

Molecular Properties

Compound Name2-methyl-3-morpholin-2-ylprop-2-enamide
PubChem CID68744206
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name2-methyl-3-morpholin-2-ylprop-2-enamide
SMILESCC(=CC1CNCCO1)C(N)=O
InChIInChI=1S/C8H14N2O2/c1-6(8(9)11)4-7-5-10-2-3-12-7/h4,7,10H,2-3,5H2,1H3,(H2,9,11)
InChIKeyYAJRXBRRLCUMTH-UHFFFAOYSA-N
XLogP-0.59
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-morpholin-2-ylprop-2-enamide?
The IUPAC name of 2-methyl-3-morpholin-2-ylprop-2-enamide (CID 68744206) is 2-methyl-3-morpholin-2-ylprop-2-enamide.
What is the SMILES notation for 2-methyl-3-morpholin-2-ylprop-2-enamide?
The canonical SMILES for 2-methyl-3-morpholin-2-ylprop-2-enamide is CC(=CC1CNCCO1)C(N)=O.
What is the InChIKey of 2-methyl-3-morpholin-2-ylprop-2-enamide?
The InChIKey is YAJRXBRRLCUMTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-6(8(9)11)4-7-5-10-2-3-12-7/h4,7,10H,2-3,5H2,1H3,(H2,9,11).
What are the key properties of 2-methyl-3-morpholin-2-ylprop-2-enamide?
2-methyl-3-morpholin-2-ylprop-2-enamide has a molecular weight of 170.21 g/mol, XLogP of -0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-morpholin-2-ylprop-2-enamide is sourced from PubChem (CID 68744206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).