7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C12H15F3N2 — CID 162684762

IUPAC7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC1CCn2c(cnc2C2(C(F)(F)F)CC2)C1
InChIInChI=1S/C12H15F3N2/c1-8-2-5-17-9(6-8)7-16-10(17)11(3-4-11)12(13,14)15/h7-8H,2-6H2,1H3
InChIKeyRPSQQFRNDNYEMI-UHFFFAOYSA-N
MW244.26 g/mol
LogP3.06
Rot. Bonds1

About 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 162684762) has the molecular formula C12H15F3N2 and a molecular weight of 244.26 g/mol. Its IUPAC name is 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID162684762
Molecular FormulaC12H15F3N2
Molecular Weight244.26 g/mol
Exact Mass244.12
IUPAC Name7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC1CCn2c(cnc2C2(C(F)(F)F)CC2)C1
InChIInChI=1S/C12H15F3N2/c1-8-2-5-17-9(6-8)7-16-10(17)11(3-4-11)12(13,14)15/h7-8H,2-6H2,1H3
InChIKeyRPSQQFRNDNYEMI-UHFFFAOYSA-N
XLogP3.06
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 162684762) is 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CC1CCn2c(cnc2C2(C(F)(F)F)CC2)C1.
What is the InChIKey of 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is RPSQQFRNDNYEMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2/c1-8-2-5-17-9(6-8)7-16-10(17)11(3-4-11)12(13,14)15/h7-8H,2-6H2,1H3.
What are the key properties of 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 244.26 g/mol, XLogP of 3.06, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 162684762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).