(3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine

C9H12FNO — CID 144959959

IUPAC(3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine
SMILESC=C(C)/C(F)=C1/NCCOC1=C
InChIInChI=1S/C9H12FNO/c1-6(2)8(10)9-7(3)12-5-4-11-9/h11H,1,3-5H2,2H3/b9-8-
InChIKeyBDSAIAYYPOLTHV-HJWRWDBZSA-N
MW169.20 g/mol
LogP1.88
Rot. Bonds1

About (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine

(3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine (PubChem CID 144959959) has the molecular formula C9H12FNO and a molecular weight of 169.20 g/mol. Its IUPAC name is (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine.

Molecular Properties

Compound Name(3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine
PubChem CID144959959
Molecular FormulaC9H12FNO
Molecular Weight169.20 g/mol
Exact Mass169.09
IUPAC Name(3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine
SMILESC=C(C)/C(F)=C1/NCCOC1=C
InChIInChI=1S/C9H12FNO/c1-6(2)8(10)9-7(3)12-5-4-11-9/h11H,1,3-5H2,2H3/b9-8-
InChIKeyBDSAIAYYPOLTHV-HJWRWDBZSA-N
XLogP1.88
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.20
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine?
The IUPAC name of (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine (CID 144959959) is (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine.
What is the SMILES notation for (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine?
The canonical SMILES for (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine is C=C(C)/C(F)=C1/NCCOC1=C.
What is the InChIKey of (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine?
The InChIKey is BDSAIAYYPOLTHV-HJWRWDBZSA-N. The full InChI is InChI=1S/C9H12FNO/c1-6(2)8(10)9-7(3)12-5-4-11-9/h11H,1,3-5H2,2H3/b9-8-.
What are the key properties of (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine?
(3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine has a molecular weight of 169.20 g/mol, XLogP of 1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine is sourced from PubChem (CID 144959959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).