N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide

C12H22N2O3 — CID 106398279

IUPACN-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide
SMILESC=CCCOCCNC(=O)CC1CNCCO1
InChIInChI=1S/C12H22N2O3/c1-2-3-6-16-7-5-14-12(15)9-11-10-13-4-8-17-11/h2,11,13H,1,3-10H2,(H,14,15)
InChIKeyCJRVFNNMLZWALD-UHFFFAOYSA-N
MW242.32 g/mol
LogP0.07
Rot. Bonds8

About N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide

N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide (PubChem CID 106398279) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide
PubChem CID106398279
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC NameN-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide
SMILESC=CCCOCCNC(=O)CC1CNCCO1
InChIInChI=1S/C12H22N2O3/c1-2-3-6-16-7-5-14-12(15)9-11-10-13-4-8-17-11/h2,11,13H,1,3-10H2,(H,14,15)
InChIKeyCJRVFNNMLZWALD-UHFFFAOYSA-N
XLogP0.07
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide?
The IUPAC name of N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide (CID 106398279) is N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide?
The canonical SMILES for N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide is C=CCCOCCNC(=O)CC1CNCCO1.
What is the InChIKey of N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide?
The InChIKey is CJRVFNNMLZWALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-2-3-6-16-7-5-14-12(15)9-11-10-13-4-8-17-11/h2,11,13H,1,3-10H2,(H,14,15).
What are the key properties of N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide?
N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide has a molecular weight of 242.32 g/mol, XLogP of 0.07, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-but-3-enoxyethyl)-2-morpholin-2-ylacetamide is sourced from PubChem (CID 106398279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).