3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine

C12H11F3N2 — CID 166079051

IUPAC3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine
SMILESC=C(C)N1C=C2C(C(F)(F)F)=CC=CN2C1=C
InChIInChI=1S/C12H11F3N2/c1-8(2)17-7-11-10(12(13,14)15)5-4-6-16(11)9(17)3/h4-7H,1,3H2,2H3
InChIKeyQNQDJZMFBAJRNZ-UHFFFAOYSA-N
MW240.23 g/mol
LogP3.47
Rot. Bonds1

About 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine

3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine (PubChem CID 166079051) has the molecular formula C12H11F3N2 and a molecular weight of 240.23 g/mol. Its IUPAC name is 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine
PubChem CID166079051
Molecular FormulaC12H11F3N2
Molecular Weight240.23 g/mol
Exact Mass240.09
IUPAC Name3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine
SMILESC=C(C)N1C=C2C(C(F)(F)F)=CC=CN2C1=C
InChIInChI=1S/C12H11F3N2/c1-8(2)17-7-11-10(12(13,14)15)5-4-6-16(11)9(17)3/h4-7H,1,3H2,2H3
InChIKeyQNQDJZMFBAJRNZ-UHFFFAOYSA-N
XLogP3.47
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.23
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine?
The IUPAC name of 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine (CID 166079051) is 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine is C=C(C)N1C=C2C(C(F)(F)F)=CC=CN2C1=C.
What is the InChIKey of 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine?
The InChIKey is QNQDJZMFBAJRNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N2/c1-8(2)17-7-11-10(12(13,14)15)5-4-6-16(11)9(17)3/h4-7H,1,3H2,2H3.
What are the key properties of 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine?
3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine has a molecular weight of 240.23 g/mol, XLogP of 3.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-2-prop-1-en-2-yl-8-(trifluoromethyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 166079051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).