[2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine

C18H20FN3 — CID 82060626

IUPAC[2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCC(C)(C)c1ccc(-c2nc3ccc(F)cn3c2CN)cc1
InChIInChI=1S/C18H20FN3/c1-18(2,3)13-6-4-12(5-7-13)17-15(10-20)22-11-14(19)8-9-16(22)21-17/h4-9,11H,10,20H2,1-3H3
InChIKeyFQPGMHNMWDJGSW-UHFFFAOYSA-N
MW297.38 g/mol
LogP3.90
Rot. Bonds2

About [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine

[2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine (PubChem CID 82060626) has the molecular formula C18H20FN3 and a molecular weight of 297.38 g/mol. Its IUPAC name is [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
PubChem CID82060626
Molecular FormulaC18H20FN3
Molecular Weight297.38 g/mol
Exact Mass297.16
IUPAC Name[2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCC(C)(C)c1ccc(-c2nc3ccc(F)cn3c2CN)cc1
InChIInChI=1S/C18H20FN3/c1-18(2,3)13-6-4-12(5-7-13)17-15(10-20)22-11-14(19)8-9-16(22)21-17/h4-9,11H,10,20H2,1-3H3
InChIKeyFQPGMHNMWDJGSW-UHFFFAOYSA-N
XLogP3.90
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine?
The IUPAC name of [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine (CID 82060626) is [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine.
What is the SMILES notation for [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine?
The canonical SMILES for [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine is CC(C)(C)c1ccc(-c2nc3ccc(F)cn3c2CN)cc1.
What is the InChIKey of [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine?
The InChIKey is FQPGMHNMWDJGSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3/c1-18(2,3)13-6-4-12(5-7-13)17-15(10-20)22-11-14(19)8-9-16(22)21-17/h4-9,11H,10,20H2,1-3H3.
What are the key properties of [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine?
[2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine has a molecular weight of 297.38 g/mol, XLogP of 3.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine is sourced from PubChem (CID 82060626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).