N-(2-but-3-enoxyethyl)morpholine-4-carboxamide

C11H20N2O3 — CID 103853131

IUPACN-(2-but-3-enoxyethyl)morpholine-4-carboxamide
SMILESC=CCCOCCNC(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O3/c1-2-3-7-15-8-4-12-11(14)13-5-9-16-10-6-13/h2H,1,3-10H2,(H,12,14)
InChIKeyBSGQIZQNTZWNSP-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.62
Rot. Bonds6

About N-(2-but-3-enoxyethyl)morpholine-4-carboxamide

N-(2-but-3-enoxyethyl)morpholine-4-carboxamide (PubChem CID 103853131) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-(2-but-3-enoxyethyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2-but-3-enoxyethyl)morpholine-4-carboxamide
PubChem CID103853131
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-(2-but-3-enoxyethyl)morpholine-4-carboxamide
SMILESC=CCCOCCNC(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O3/c1-2-3-7-15-8-4-12-11(14)13-5-9-16-10-6-13/h2H,1,3-10H2,(H,12,14)
InChIKeyBSGQIZQNTZWNSP-UHFFFAOYSA-N
XLogP0.62
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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)morpholine-4-carboxamide?
The IUPAC name of N-(2-but-3-enoxyethyl)morpholine-4-carboxamide (CID 103853131) is N-(2-but-3-enoxyethyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(2-but-3-enoxyethyl)morpholine-4-carboxamide?
The canonical SMILES for N-(2-but-3-enoxyethyl)morpholine-4-carboxamide is C=CCCOCCNC(=O)N1CCOCC1.
What is the InChIKey of N-(2-but-3-enoxyethyl)morpholine-4-carboxamide?
The InChIKey is BSGQIZQNTZWNSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-2-3-7-15-8-4-12-11(14)13-5-9-16-10-6-13/h2H,1,3-10H2,(H,12,14).
What are the key properties of N-(2-but-3-enoxyethyl)morpholine-4-carboxamide?
N-(2-but-3-enoxyethyl)morpholine-4-carboxamide has a molecular weight of 228.29 g/mol, XLogP of 0.62, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-but-3-enoxyethyl)morpholine-4-carboxamide is sourced from PubChem (CID 103853131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).