N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine

C19H22FN3 — CID 809241

IUPACN-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cc(C)n2c(NC(C)(C)C)c(-c3ccccc3F)nc2c1
InChIInChI=1S/C19H22FN3/c1-12-10-13(2)23-16(11-12)21-17(18(23)22-19(3,4)5)14-8-6-7-9-15(14)20/h6-11,22H,1-5H3
InChIKeyAJDXCSLFKXIKMK-UHFFFAOYSA-N
MW311.40 g/mol
LogP4.97
Rot. Bonds2

About N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine

N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine (PubChem CID 809241) has the molecular formula C19H22FN3 and a molecular weight of 311.40 g/mol. Its IUPAC name is N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
PubChem CID809241
Molecular FormulaC19H22FN3
Molecular Weight311.40 g/mol
Exact Mass311.18
IUPAC NameN-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cc(C)n2c(NC(C)(C)C)c(-c3ccccc3F)nc2c1
InChIInChI=1S/C19H22FN3/c1-12-10-13(2)23-16(11-12)21-17(18(23)22-19(3,4)5)14-8-6-7-9-15(14)20/h6-11,22H,1-5H3
InChIKeyAJDXCSLFKXIKMK-UHFFFAOYSA-N
XLogP4.97
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.40
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine (CID 809241) is N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine is Cc1cc(C)n2c(NC(C)(C)C)c(-c3ccccc3F)nc2c1.
What is the InChIKey of N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is AJDXCSLFKXIKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3/c1-12-10-13(2)23-16(11-12)21-17(18(23)22-19(3,4)5)14-8-6-7-9-15(14)20/h6-11,22H,1-5H3.
What are the key properties of N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine?
N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 311.40 g/mol, XLogP of 4.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(2-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 809241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).