1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine

C14H9ClF3N3 — CID 117250673

IUPAC1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine
SMILESNc1cccc2c(Cl)nc(-c3cccc(C(F)(F)F)c3)n12
InChIInChI=1S/C14H9ClF3N3/c15-12-10-5-2-6-11(19)21(10)13(20-12)8-3-1-4-9(7-8)14(16,17)18/h1-7H,19H2
InChIKeyYUVWLYFLWRPCPE-UHFFFAOYSA-N
MW311.69 g/mol
LogP4.26
Rot. Bonds1

About 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine

1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine (PubChem CID 117250673) has the molecular formula C14H9ClF3N3 and a molecular weight of 311.69 g/mol. Its IUPAC name is 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine
PubChem CID117250673
Molecular FormulaC14H9ClF3N3
Molecular Weight311.69 g/mol
Exact Mass311.04
IUPAC Name1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine
SMILESNc1cccc2c(Cl)nc(-c3cccc(C(F)(F)F)c3)n12
InChIInChI=1S/C14H9ClF3N3/c15-12-10-5-2-6-11(19)21(10)13(20-12)8-3-1-4-9(7-8)14(16,17)18/h1-7H,19H2
InChIKeyYUVWLYFLWRPCPE-UHFFFAOYSA-N
XLogP4.26
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.69
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine?
The IUPAC name of 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine (CID 117250673) is 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine?
The canonical SMILES for 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine is Nc1cccc2c(Cl)nc(-c3cccc(C(F)(F)F)c3)n12.
What is the InChIKey of 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine?
The InChIKey is YUVWLYFLWRPCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClF3N3/c15-12-10-5-2-6-11(19)21(10)13(20-12)8-3-1-4-9(7-8)14(16,17)18/h1-7H,19H2.
What are the key properties of 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine?
1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine has a molecular weight of 311.69 g/mol, XLogP of 4.26, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 117250673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).