N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine

C13H18F3N7 — CID 136569482

IUPACN-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine
SMILESCCN(C)c1nnnn1Cc1nc(C(F)(F)F)n2c1CCCC2
InChIInChI=1S/C13H18F3N7/c1-3-21(2)12-18-19-20-23(12)8-9-10-6-4-5-7-22(10)11(17-9)13(14,15)16/h3-8H2,1-2H3
InChIKeyYFFZHXQHYIPADS-UHFFFAOYSA-N
MW329.33 g/mol
LogP1.73
Rot. Bonds4

About N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine

N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine (PubChem CID 136569482) has the molecular formula C13H18F3N7 and a molecular weight of 329.33 g/mol. Its IUPAC name is N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine.

Molecular Properties

Compound NameN-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine
PubChem CID136569482
Molecular FormulaC13H18F3N7
Molecular Weight329.33 g/mol
Exact Mass329.16
IUPAC NameN-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine
SMILESCCN(C)c1nnnn1Cc1nc(C(F)(F)F)n2c1CCCC2
InChIInChI=1S/C13H18F3N7/c1-3-21(2)12-18-19-20-23(12)8-9-10-6-4-5-7-22(10)11(17-9)13(14,15)16/h3-8H2,1-2H3
InChIKeyYFFZHXQHYIPADS-UHFFFAOYSA-N
XLogP1.73
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.33
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-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-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine?
The IUPAC name of N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine (CID 136569482) is N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine.
What is the SMILES notation for N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine?
The canonical SMILES for N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine is CCN(C)c1nnnn1Cc1nc(C(F)(F)F)n2c1CCCC2.
What is the InChIKey of N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine?
The InChIKey is YFFZHXQHYIPADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18F3N7/c1-3-21(2)12-18-19-20-23(12)8-9-10-6-4-5-7-22(10)11(17-9)13(14,15)16/h3-8H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine?
N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine has a molecular weight of 329.33 g/mol, XLogP of 1.73, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-1-[[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methyl]tetrazol-5-amine is sourced from PubChem (CID 136569482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).