N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine

C13H12F3N5 — CID 75438747

IUPACN-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine
SMILESFC(F)(F)Cn1cc(NCc2cn3ccccc3n2)cn1
InChIInChI=1S/C13H12F3N5/c14-13(15,16)9-21-8-10(6-18-21)17-5-11-7-20-4-2-1-3-12(20)19-11/h1-4,6-8,17H,5,9H2
InChIKeyGIBWHIHWOLLTGG-UHFFFAOYSA-N
MW295.27 g/mol
LogP2.71
Rot. Bonds4

About N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine (PubChem CID 75438747) has the molecular formula C13H12F3N5 and a molecular weight of 295.27 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine
PubChem CID75438747
Molecular FormulaC13H12F3N5
Molecular Weight295.27 g/mol
Exact Mass295.10
IUPAC NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine
SMILESFC(F)(F)Cn1cc(NCc2cn3ccccc3n2)cn1
InChIInChI=1S/C13H12F3N5/c14-13(15,16)9-21-8-10(6-18-21)17-5-11-7-20-4-2-1-3-12(20)19-11/h1-4,6-8,17H,5,9H2
InChIKeyGIBWHIHWOLLTGG-UHFFFAOYSA-N
XLogP2.71
TPSA47.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.27
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 759208
4-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 2967719
N-(imidazo[1,2-a]pyridin-2-ylmethyl)naphthalen-2-amine
CID 43400804
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpropan-2-amine
CID 28586618
3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 4701924
1-tert-butyl-3-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylguanidine
CID 119116119
4-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methylaniline
CID 55118825
1-imidazo[1,2-a]pyridin-2-yl-N-[[1-methyl-4-(trifluoromethyl)pyrazol-5-yl]methyl]methanamine
CID 126818034
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-propan-2-yloxyaniline
CID 43123163
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methylsulfanylaniline
CID 43179471
1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylguanidine
CID 110913540
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-phenylaniline
CID 43825852

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine?
The IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine (CID 75438747) is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine is FC(F)(F)Cn1cc(NCc2cn3ccccc3n2)cn1.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine?
The InChIKey is GIBWHIHWOLLTGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F3N5/c14-13(15,16)9-21-8-10(6-18-21)17-5-11-7-20-4-2-1-3-12(20)19-11/h1-4,6-8,17H,5,9H2.
What are the key properties of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine?
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine has a molecular weight of 295.27 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(2,2,2-trifluoroethyl)pyrazol-4-amine is sourced from PubChem (CID 75438747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).