7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

C11H16F3N3 — CID 67978420

IUPAC7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCCCCN1CCn2cc(C(F)(F)F)nc2C1
InChIInChI=1S/C11H16F3N3/c1-2-3-4-16-5-6-17-7-9(11(12,13)14)15-10(17)8-16/h7H,2-6,8H2,1H3
InChIKeyOFPWDEFNIZSZHT-UHFFFAOYSA-N
MW247.26 g/mol
LogP2.52
Rot. Bonds3

About 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (PubChem CID 67978420) has the molecular formula C11H16F3N3 and a molecular weight of 247.26 g/mol. Its IUPAC name is 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
PubChem CID67978420
Molecular FormulaC11H16F3N3
Molecular Weight247.26 g/mol
Exact Mass247.13
IUPAC Name7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCCCCN1CCn2cc(C(F)(F)F)nc2C1
InChIInChI=1S/C11H16F3N3/c1-2-3-4-16-5-6-17-7-9(11(12,13)14)15-10(17)8-16/h7H,2-6,8H2,1H3
InChIKeyOFPWDEFNIZSZHT-UHFFFAOYSA-N
XLogP2.52
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5H,6H,7H,8H-imidazo(1,2-a)pyridin-2-ylmethanamine
CID 47003215
3-Isopropyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 9855566
1-Butyl-5-methyl-1H-imidazole
CID 426631
1H-Imidazole, 1-butyl-4-methyl
CID 529330
{5H,6H,7H,8H-imidazo[1,2-a]pyridin-2-ylmethyl}(methyl)amine
CID 82596909
2-(Trifluoromethyl)imidazo[1,2-a]pyrazine
CID 3231306
2-methyl-5H,6H,7H,8H-imidazo(1,2-a)pyrazine
CID 14719924
2-(trifluoromethyl)-5H,6H,7H,8H-imidazo[1,2-a]pyrazine
CID 14719928
3-(trifluoromethyl)-5H,6H,7H,8H-imidazo(1,5-a)pyrazine
CID 34176314
2-methyl-5H,6H,7H,8H-imidazo[1,2-a]pyridin-6-amine
CID 43370280
8-methyl-2-(trifluoromethyl)-5H,6H,7H,8H-imidazo(1,2-a)pyrazine
CID 45480427
3-methyl-5H,6H,7H,8H-imidazo(1,5-a)pyridine
CID 56972745

Frequently Asked Questions

What is the IUPAC name of 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The IUPAC name of 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (CID 67978420) is 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.
What is the SMILES notation for 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The canonical SMILES for 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is CCCCN1CCn2cc(C(F)(F)F)nc2C1.
What is the InChIKey of 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The InChIKey is OFPWDEFNIZSZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F3N3/c1-2-3-4-16-5-6-17-7-9(11(12,13)14)15-10(17)8-16/h7H,2-6,8H2,1H3.
What are the key properties of 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine has a molecular weight of 247.26 g/mol, XLogP of 2.52, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is sourced from PubChem (CID 67978420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).