1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine

C8H9ClF3N3 — CID 83869748

IUPAC1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine
SMILESNC1CCc2c(Cl)nc(C(F)(F)F)n2C1
InChIInChI=1S/C8H9ClF3N3/c9-6-5-2-1-4(13)3-15(5)7(14-6)8(10,11)12/h4H,1-3,13H2
InChIKeyPYHMBIBTYCBNJZ-UHFFFAOYSA-N
MW239.63 g/mol
LogP1.83
Rot. Bonds

About 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine

1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine (PubChem CID 83869748) has the molecular formula C8H9ClF3N3 and a molecular weight of 239.63 g/mol. Its IUPAC name is 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine.

Molecular Properties

Compound Name1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine
PubChem CID83869748
Molecular FormulaC8H9ClF3N3
Molecular Weight239.63 g/mol
Exact Mass239.04
IUPAC Name1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine
SMILESNC1CCc2c(Cl)nc(C(F)(F)F)n2C1
InChIInChI=1S/C8H9ClF3N3/c9-6-5-2-1-4(13)3-15(5)7(14-6)8(10,11)12/h4H,1-3,13H2
InChIKeyPYHMBIBTYCBNJZ-UHFFFAOYSA-N
XLogP1.83
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.63
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine?
The IUPAC name of 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine (CID 83869748) is 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine.
What is the SMILES notation for 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine?
The canonical SMILES for 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine is NC1CCc2c(Cl)nc(C(F)(F)F)n2C1.
What is the InChIKey of 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine?
The InChIKey is PYHMBIBTYCBNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClF3N3/c9-6-5-2-1-4(13)3-15(5)7(14-6)8(10,11)12/h4H,1-3,13H2.
What are the key properties of 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine?
1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine has a molecular weight of 239.63 g/mol, XLogP of 1.83, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-amine is sourced from PubChem (CID 83869748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).