(4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine

C8H10FN3 — CID 170019178

IUPAC(4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine
SMILESC=C/C(F)=c1/nc(N)n(C)c1=C
InChIInChI=1S/C8H10FN3/c1-4-6(9)7-5(2)12(3)8(10)11-7/h4H,1-2H2,3H3,(H2,10,11)/b7-6-
InChIKeyTVIOVRWGNWNGBD-SREVYHEPSA-N
MW167.19 g/mol
LogP-0.32
Rot. Bonds1

About (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine

(4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine (PubChem CID 170019178) has the molecular formula C8H10FN3 and a molecular weight of 167.19 g/mol. Its IUPAC name is (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine.

Molecular Properties

Compound Name(4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine
PubChem CID170019178
Molecular FormulaC8H10FN3
Molecular Weight167.19 g/mol
Exact Mass167.09
IUPAC Name(4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine
SMILESC=C/C(F)=c1/nc(N)n(C)c1=C
InChIInChI=1S/C8H10FN3/c1-4-6(9)7-5(2)12(3)8(10)11-7/h4H,1-2H2,3H3,(H2,10,11)/b7-6-
InChIKeyTVIOVRWGNWNGBD-SREVYHEPSA-N
XLogP-0.32
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.19
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine?
The IUPAC name of (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine (CID 170019178) is (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine.
What is the SMILES notation for (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine?
The canonical SMILES for (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine is C=C/C(F)=c1/nc(N)n(C)c1=C.
What is the InChIKey of (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine?
The InChIKey is TVIOVRWGNWNGBD-SREVYHEPSA-N. The full InChI is InChI=1S/C8H10FN3/c1-4-6(9)7-5(2)12(3)8(10)11-7/h4H,1-2H2,3H3,(H2,10,11)/b7-6-.
What are the key properties of (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine?
(4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine has a molecular weight of 167.19 g/mol, XLogP of -0.32, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-(1-fluoroprop-2-enylidene)-1-methyl-5-methylideneimidazol-2-amine is sourced from PubChem (CID 170019178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).