6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide

C25H25N3O2 — CID 84555081

IUPAC6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2nc3ccc(C)cn3c2C(=O)Nc2ccccc2OC(C)C)cc1
InChIInChI=1S/C25H25N3O2/c1-16(2)30-21-8-6-5-7-20(21)26-25(29)24-23(19-12-9-17(3)10-13-19)27-22-14-11-18(4)15-28(22)24/h5-16H,1-4H3,(H,26,29)
InChIKeySRZMKGQHBDYLLX-UHFFFAOYSA-N
MW399.49 g/mol
LogP5.66
Rot. Bonds5

About 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide

6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 84555081) has the molecular formula C25H25N3O2 and a molecular weight of 399.49 g/mol. Its IUPAC name is 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID84555081
Molecular FormulaC25H25N3O2
Molecular Weight399.49 g/mol
Exact Mass399.19
IUPAC Name6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2nc3ccc(C)cn3c2C(=O)Nc2ccccc2OC(C)C)cc1
InChIInChI=1S/C25H25N3O2/c1-16(2)30-21-8-6-5-7-20(21)26-25(29)24-23(19-12-9-17(3)10-13-19)27-22-14-11-18(4)15-28(22)24/h5-16H,1-4H3,(H,26,29)
InChIKeySRZMKGQHBDYLLX-UHFFFAOYSA-N
XLogP5.66
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.49
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide (CID 84555081) is 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc(-c2nc3ccc(C)cn3c2C(=O)Nc2ccccc2OC(C)C)cc1.
What is the InChIKey of 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is SRZMKGQHBDYLLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O2/c1-16(2)30-21-8-6-5-7-20(21)26-25(29)24-23(19-12-9-17(3)10-13-19)27-22-14-11-18(4)15-28(22)24/h5-16H,1-4H3,(H,26,29).
What are the key properties of 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide?
6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 399.49 g/mol, XLogP of 5.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(4-methylphenyl)-N-(2-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 84555081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).