N-(2-morpholin-2-ylethyl)prop-2-enamide

C9H16N2O2 — CID 54481936

IUPACN-(2-morpholin-2-ylethyl)prop-2-enamide
SMILESC=CC(=O)NCCC1CNCCO1
InChIInChI=1S/C9H16N2O2/c1-2-9(12)11-4-3-8-7-10-5-6-13-8/h2,8,10H,1,3-7H2,(H,11,12)
InChIKeyXPPGMIOYKBXNGY-UHFFFAOYSA-N
MW184.24 g/mol
LogP-0.33
Rot. Bonds4

About N-(2-morpholin-2-ylethyl)prop-2-enamide

N-(2-morpholin-2-ylethyl)prop-2-enamide (PubChem CID 54481936) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-(2-morpholin-2-ylethyl)prop-2-enamide.

Molecular Properties

Compound NameN-(2-morpholin-2-ylethyl)prop-2-enamide
PubChem CID54481936
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-(2-morpholin-2-ylethyl)prop-2-enamide
SMILESC=CC(=O)NCCC1CNCCO1
InChIInChI=1S/C9H16N2O2/c1-2-9(12)11-4-3-8-7-10-5-6-13-8/h2,8,10H,1,3-7H2,(H,11,12)
InChIKeyXPPGMIOYKBXNGY-UHFFFAOYSA-N
XLogP-0.33
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.33
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 N-(2-morpholin-2-ylethyl)prop-2-enamide?
The IUPAC name of N-(2-morpholin-2-ylethyl)prop-2-enamide (CID 54481936) is N-(2-morpholin-2-ylethyl)prop-2-enamide.
What is the SMILES notation for N-(2-morpholin-2-ylethyl)prop-2-enamide?
The canonical SMILES for N-(2-morpholin-2-ylethyl)prop-2-enamide is C=CC(=O)NCCC1CNCCO1.
What is the InChIKey of N-(2-morpholin-2-ylethyl)prop-2-enamide?
The InChIKey is XPPGMIOYKBXNGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-2-9(12)11-4-3-8-7-10-5-6-13-8/h2,8,10H,1,3-7H2,(H,11,12).
What are the key properties of N-(2-morpholin-2-ylethyl)prop-2-enamide?
N-(2-morpholin-2-ylethyl)prop-2-enamide has a molecular weight of 184.24 g/mol, XLogP of -0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-2-ylethyl)prop-2-enamide is sourced from PubChem (CID 54481936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).