2-butylidenemorpholine

C8H15NO — CID 174345503

IUPAC2-butylidenemorpholine
SMILESCCCC=C1CNCCO1
InChIInChI=1S/C8H15NO/c1-2-3-4-8-7-9-5-6-10-8/h4,9H,2-3,5-7H2,1H3
InChIKeyAUFZAMZGEOTDNB-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.29
Rot. Bonds2

About 2-butylidenemorpholine

2-butylidenemorpholine (PubChem CID 174345503) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-butylidenemorpholine.

Molecular Properties

Compound Name2-butylidenemorpholine
PubChem CID174345503
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-butylidenemorpholine
SMILESCCCC=C1CNCCO1
InChIInChI=1S/C8H15NO/c1-2-3-4-8-7-9-5-6-10-8/h4,9H,2-3,5-7H2,1H3
InChIKeyAUFZAMZGEOTDNB-UHFFFAOYSA-N
XLogP1.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-butylidenemorpholine?
The IUPAC name of 2-butylidenemorpholine (CID 174345503) is 2-butylidenemorpholine.
What is the SMILES notation for 2-butylidenemorpholine?
The canonical SMILES for 2-butylidenemorpholine is CCCC=C1CNCCO1.
What is the InChIKey of 2-butylidenemorpholine?
The InChIKey is AUFZAMZGEOTDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-2-3-4-8-7-9-5-6-10-8/h4,9H,2-3,5-7H2,1H3.
What are the key properties of 2-butylidenemorpholine?
2-butylidenemorpholine has a molecular weight of 141.21 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butylidenemorpholine is sourced from PubChem (CID 174345503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).