3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine

C19H22N2 — CID 114933820

IUPAC3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine
SMILESCc1cc(C)n2c(-c3ccc(C(C)(C)C)cc3)cnc2c1
InChIInChI=1S/C19H22N2/c1-13-10-14(2)21-17(12-20-18(21)11-13)15-6-8-16(9-7-15)19(3,4)5/h6-12H,1-5H3
InChIKeyCYAWCBJNVQBPIP-UHFFFAOYSA-N
MW278.40 g/mol
LogP4.92
Rot. Bonds1

About 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine

3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine (PubChem CID 114933820) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine
PubChem CID114933820
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC Name3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine
SMILESCc1cc(C)n2c(-c3ccc(C(C)(C)C)cc3)cnc2c1
InChIInChI=1S/C19H22N2/c1-13-10-14(2)21-17(12-20-18(21)11-13)15-6-8-16(9-7-15)19(3,4)5/h6-12H,1-5H3
InChIKeyCYAWCBJNVQBPIP-UHFFFAOYSA-N
XLogP4.92
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine?
The IUPAC name of 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine (CID 114933820) is 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine is Cc1cc(C)n2c(-c3ccc(C(C)(C)C)cc3)cnc2c1.
What is the InChIKey of 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine?
The InChIKey is CYAWCBJNVQBPIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2/c1-13-10-14(2)21-17(12-20-18(21)11-13)15-6-8-16(9-7-15)19(3,4)5/h6-12H,1-5H3.
What are the key properties of 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine?
3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine has a molecular weight of 278.40 g/mol, XLogP of 4.92, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-tert-butylphenyl)-5,7-dimethylimidazo[1,2-a]pyridine is sourced from PubChem (CID 114933820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).