2-but-1-en-2-yloxybut-1-ene;morpholine

C12H23NO2 — CID 69019427

IUPAC2-but-1-en-2-yloxybut-1-ene;morpholine
SMILESC1COCCN1.C=C(CC)OC(=C)CC
InChIInChI=1S/C8H14O.C4H9NO/c1-5-7(3)9-8(4)6-2;1-3-6-4-2-5-1/h3-6H2,1-2H3;5H,1-4H2
InChIKeyFKYBRGNYPUXUCE-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.46
Rot. Bonds4

About 2-but-1-en-2-yloxybut-1-ene;morpholine

2-but-1-en-2-yloxybut-1-ene;morpholine (PubChem CID 69019427) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-but-1-en-2-yloxybut-1-ene;morpholine.

Molecular Properties

Compound Name2-but-1-en-2-yloxybut-1-ene;morpholine
PubChem CID69019427
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-but-1-en-2-yloxybut-1-ene;morpholine
SMILESC1COCCN1.C=C(CC)OC(=C)CC
InChIInChI=1S/C8H14O.C4H9NO/c1-5-7(3)9-8(4)6-2;1-3-6-4-2-5-1/h3-6H2,1-2H3;5H,1-4H2
InChIKeyFKYBRGNYPUXUCE-UHFFFAOYSA-N
XLogP2.46
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-but-1-en-2-yloxybut-1-ene;morpholine?
The IUPAC name of 2-but-1-en-2-yloxybut-1-ene;morpholine (CID 69019427) is 2-but-1-en-2-yloxybut-1-ene;morpholine.
What is the SMILES notation for 2-but-1-en-2-yloxybut-1-ene;morpholine?
The canonical SMILES for 2-but-1-en-2-yloxybut-1-ene;morpholine is C1COCCN1.C=C(CC)OC(=C)CC.
What is the InChIKey of 2-but-1-en-2-yloxybut-1-ene;morpholine?
The InChIKey is FKYBRGNYPUXUCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O.C4H9NO/c1-5-7(3)9-8(4)6-2;1-3-6-4-2-5-1/h3-6H2,1-2H3;5H,1-4H2.
What are the key properties of 2-but-1-en-2-yloxybut-1-ene;morpholine?
2-but-1-en-2-yloxybut-1-ene;morpholine has a molecular weight of 213.32 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-but-1-en-2-yloxybut-1-ene;morpholine is sourced from PubChem (CID 69019427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).