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

C9H7F3N2 — CID 166079837

IUPAC3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine
SMILESC=C1NC=C2C(C(F)(F)F)=CC=CN12
InChIInChI=1S/C9H7F3N2/c1-6-13-5-8-7(9(10,11)12)3-2-4-14(6)8/h2-5,13H,1H2
InChIKeyGSPOTDJFVCSITI-UHFFFAOYSA-N
MW200.16 g/mol
LogP2.22
Rot. Bonds

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

3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine (PubChem CID 166079837) has the molecular formula C9H7F3N2 and a molecular weight of 200.16 g/mol. Its IUPAC name is 3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine
PubChem CID166079837
Molecular FormulaC9H7F3N2
Molecular Weight200.16 g/mol
Exact Mass200.06
IUPAC Name3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine
SMILESC=C1NC=C2C(C(F)(F)F)=CC=CN12
InChIInChI=1S/C9H7F3N2/c1-6-13-5-8-7(9(10,11)12)3-2-4-14(6)8/h2-5,13H,1H2
InChIKeyGSPOTDJFVCSITI-UHFFFAOYSA-N
XLogP2.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.16
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine?
The IUPAC name of 3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine (CID 166079837) is 3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine.
What is the SMILES notation for 3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine?
The canonical SMILES for 3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine is C=C1NC=C2C(C(F)(F)F)=CC=CN12.
What is the InChIKey of 3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine?
The InChIKey is GSPOTDJFVCSITI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F3N2/c1-6-13-5-8-7(9(10,11)12)3-2-4-14(6)8/h2-5,13H,1H2.
What are the key properties of 3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine?
3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine has a molecular weight of 200.16 g/mol, XLogP of 2.22, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-8-(trifluoromethyl)-2H-imidazo[1,5-a]pyridine is sourced from PubChem (CID 166079837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).