N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine

C12H11F3N6 — CID 80840604

IUPACN-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine
SMILESCCNc1cn2ccnc2c(-n2cc(C(F)(F)F)cn2)n1
InChIInChI=1S/C12H11F3N6/c1-2-16-9-7-20-4-3-17-10(20)11(19-9)21-6-8(5-18-21)12(13,14)15/h3-7,16H,2H2,1H3
InChIKeyRSIFIXJBVPXQBS-UHFFFAOYSA-N
MW296.26 g/mol
LogP2.37
Rot. Bonds3

About N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine

N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine (PubChem CID 80840604) has the molecular formula C12H11F3N6 and a molecular weight of 296.26 g/mol. Its IUPAC name is N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound NameN-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine
PubChem CID80840604
Molecular FormulaC12H11F3N6
Molecular Weight296.26 g/mol
Exact Mass296.10
IUPAC NameN-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine
SMILESCCNc1cn2ccnc2c(-n2cc(C(F)(F)F)cn2)n1
InChIInChI=1S/C12H11F3N6/c1-2-16-9-7-20-4-3-17-10(20)11(19-9)21-6-8(5-18-21)12(13,14)15/h3-7,16H,2H2,1H3
InChIKeyRSIFIXJBVPXQBS-UHFFFAOYSA-N
XLogP2.37
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.26
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine (CID 80840604) is N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine is CCNc1cn2ccnc2c(-n2cc(C(F)(F)F)cn2)n1.
What is the InChIKey of N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is RSIFIXJBVPXQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N6/c1-2-16-9-7-20-4-3-17-10(20)11(19-9)21-6-8(5-18-21)12(13,14)15/h3-7,16H,2H2,1H3.
What are the key properties of N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine?
N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 296.26 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-8-[4-(trifluoromethyl)pyrazol-1-yl]imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80840604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).