4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine

C9H16FNO — CID 143325492

IUPAC4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine
SMILESC=C(CF)N1CC(C)OC(C)C1
InChIInChI=1S/C9H16FNO/c1-7(4-10)11-5-8(2)12-9(3)6-11/h8-9H,1,4-6H2,2-3H3
InChIKeyHZKHZVVNROXRHT-UHFFFAOYSA-N
MW173.23 g/mol
LogP1.58
Rot. Bonds2

About 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine

4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine (PubChem CID 143325492) has the molecular formula C9H16FNO and a molecular weight of 173.23 g/mol. Its IUPAC name is 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine.

Molecular Properties

Compound Name4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine
PubChem CID143325492
Molecular FormulaC9H16FNO
Molecular Weight173.23 g/mol
Exact Mass173.12
IUPAC Name4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine
SMILESC=C(CF)N1CC(C)OC(C)C1
InChIInChI=1S/C9H16FNO/c1-7(4-10)11-5-8(2)12-9(3)6-11/h8-9H,1,4-6H2,2-3H3
InChIKeyHZKHZVVNROXRHT-UHFFFAOYSA-N
XLogP1.58
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.23
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine?
The IUPAC name of 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine (CID 143325492) is 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine.
What is the SMILES notation for 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine?
The canonical SMILES for 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine is C=C(CF)N1CC(C)OC(C)C1.
What is the InChIKey of 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine?
The InChIKey is HZKHZVVNROXRHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FNO/c1-7(4-10)11-5-8(2)12-9(3)6-11/h8-9H,1,4-6H2,2-3H3.
What are the key properties of 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine?
4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine has a molecular weight of 173.23 g/mol, XLogP of 1.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoroprop-1-en-2-yl)-2,6-dimethylmorpholine is sourced from PubChem (CID 143325492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).