(4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole

C9H10FNO — CID 156867718

IUPAC(4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole
SMILESC=C(F)/C(CC)=c1/cnoc1=C
InChIInChI=1S/C9H10FNO/c1-4-8(6(2)10)9-5-11-12-7(9)3/h5H,2-4H2,1H3/b9-8-
InChIKeyXPBVGMRXNPIYJH-HJWRWDBZSA-N
MW167.18 g/mol
LogP1.13
Rot. Bonds2

About (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole

(4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole (PubChem CID 156867718) has the molecular formula C9H10FNO and a molecular weight of 167.18 g/mol. Its IUPAC name is (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole.

Molecular Properties

Compound Name(4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole
PubChem CID156867718
Molecular FormulaC9H10FNO
Molecular Weight167.18 g/mol
Exact Mass167.07
IUPAC Name(4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole
SMILESC=C(F)/C(CC)=c1/cnoc1=C
InChIInChI=1S/C9H10FNO/c1-4-8(6(2)10)9-5-11-12-7(9)3/h5H,2-4H2,1H3/b9-8-
InChIKeyXPBVGMRXNPIYJH-HJWRWDBZSA-N
XLogP1.13
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.18
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole?
The IUPAC name of (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole (CID 156867718) is (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole.
What is the SMILES notation for (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole?
The canonical SMILES for (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole is C=C(F)/C(CC)=c1/cnoc1=C.
What is the InChIKey of (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole?
The InChIKey is XPBVGMRXNPIYJH-HJWRWDBZSA-N. The full InChI is InChI=1S/C9H10FNO/c1-4-8(6(2)10)9-5-11-12-7(9)3/h5H,2-4H2,1H3/b9-8-.
What are the key properties of (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole?
(4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole has a molecular weight of 167.18 g/mol, XLogP of 1.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole is sourced from PubChem (CID 156867718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).