1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine

C11H11ClF3N3 — CID 82029153

IUPAC1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
SMILESCCC(N)c1cnc2c(Cl)cc(C(F)(F)F)cn12
InChIInChI=1S/C11H11ClF3N3/c1-2-8(16)9-4-17-10-7(12)3-6(5-18(9)10)11(13,14)15/h3-5,8H,2,16H2,1H3
InChIKeyAKVBKMXNYVVSIM-UHFFFAOYSA-N
MW277.68 g/mol
LogP3.42
Rot. Bonds2

About 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine

1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine (PubChem CID 82029153) has the molecular formula C11H11ClF3N3 and a molecular weight of 277.68 g/mol. Its IUPAC name is 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine.

Molecular Properties

Compound Name1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
PubChem CID82029153
Molecular FormulaC11H11ClF3N3
Molecular Weight277.68 g/mol
Exact Mass277.06
IUPAC Name1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
SMILESCCC(N)c1cnc2c(Cl)cc(C(F)(F)F)cn12
InChIInChI=1S/C11H11ClF3N3/c1-2-8(16)9-4-17-10-7(12)3-6(5-18(9)10)11(13,14)15/h3-5,8H,2,16H2,1H3
InChIKeyAKVBKMXNYVVSIM-UHFFFAOYSA-N
XLogP3.42
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.68
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxylate
CID 163342934
2-[8-chloro-2-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 82030290
N-[1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2,2,2-trifluoroethylidene]hydroxylamine
CID 126963652
8-chloro-3-propyl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 142870114
2-[8-chloro-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]propan-1-amine
CID 62676097
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-phenylethanamine
CID 63196526
8-chloro-3-[(4-propan-2-ylphenyl)methylsulfanyl]-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 7870694
(1R)-1-[3-[3-chloro-5-(trifluoromethyl)phenyl]imidazol-4-yl]propan-1-amine
CID 104944066
3-chloro-2-pentan-3-yl-5-(trifluoromethyl)pyridine
CID 138603693
(2R)-2-amino-N-[[8-chloro-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl]propanamide;hydrochloride
CID 119274071
3-(bromomethyl)-8-chloro-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 75176233
(1S)-1-(8-methylimidazo[1,2-a]pyridin-3-yl)propan-1-amine
CID 39122781

Frequently Asked Questions

What is the IUPAC name of 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
The IUPAC name of 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine (CID 82029153) is 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine.
What is the SMILES notation for 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
The canonical SMILES for 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine is CCC(N)c1cnc2c(Cl)cc(C(F)(F)F)cn12.
What is the InChIKey of 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
The InChIKey is AKVBKMXNYVVSIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClF3N3/c1-2-8(16)9-4-17-10-7(12)3-6(5-18(9)10)11(13,14)15/h3-5,8H,2,16H2,1H3.
What are the key properties of 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine has a molecular weight of 277.68 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine is sourced from PubChem (CID 82029153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).