1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine

C16H24ClN3 — CID 82029293

IUPAC1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine
SMILESCCCCC(N)c1c(C(C)(C)C)nc2ccc(Cl)cn12
InChIInChI=1S/C16H24ClN3/c1-5-6-7-12(18)14-15(16(2,3)4)19-13-9-8-11(17)10-20(13)14/h8-10,12H,5-7,18H2,1-4H3
InChIKeyNJNLBIUFQJCGEW-UHFFFAOYSA-N
MW293.84 g/mol
LogP4.48
Rot. Bonds4

About 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine

1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine (PubChem CID 82029293) has the molecular formula C16H24ClN3 and a molecular weight of 293.84 g/mol. Its IUPAC name is 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine.

Molecular Properties

Compound Name1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine
PubChem CID82029293
Molecular FormulaC16H24ClN3
Molecular Weight293.84 g/mol
Exact Mass293.17
IUPAC Name1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine
SMILESCCCCC(N)c1c(C(C)(C)C)nc2ccc(Cl)cn12
InChIInChI=1S/C16H24ClN3/c1-5-6-7-12(18)14-15(16(2,3)4)19-13-9-8-11(17)10-20(13)14/h8-10,12H,5-7,18H2,1-4H3
InChIKeyNJNLBIUFQJCGEW-UHFFFAOYSA-N
XLogP4.48
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.84
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine?
The IUPAC name of 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine (CID 82029293) is 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine.
What is the SMILES notation for 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine?
The canonical SMILES for 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine is CCCCC(N)c1c(C(C)(C)C)nc2ccc(Cl)cn12.
What is the InChIKey of 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine?
The InChIKey is NJNLBIUFQJCGEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3/c1-5-6-7-12(18)14-15(16(2,3)4)19-13-9-8-11(17)10-20(13)14/h8-10,12H,5-7,18H2,1-4H3.
What are the key properties of 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine?
1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine has a molecular weight of 293.84 g/mol, XLogP of 4.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-tert-butyl-6-chloroimidazo[1,2-a]pyridin-3-yl)pentan-1-amine is sourced from PubChem (CID 82029293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).