6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

C25H24N4O2 — CID 138706951

IUPAC6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cccc(-c2ccccc2-c2ccc3ncc(C(=O)NC4CCOCC4)n3c2)n1
InChIInChI=1S/C25H24N4O2/c1-17-5-4-8-22(27-17)21-7-3-2-6-20(21)18-9-10-24-26-15-23(29(24)16-18)25(30)28-19-11-13-31-14-12-19/h2-10,15-16,19H,11-14H2,1H3,(H,28,30)
InChIKeyVCIPDKJIEHPTDC-UHFFFAOYSA-N
MW412.49 g/mol
LogP4.28
Rot. Bonds4

About 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 138706951) has the molecular formula C25H24N4O2 and a molecular weight of 412.49 g/mol. Its IUPAC name is 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID138706951
Molecular FormulaC25H24N4O2
Molecular Weight412.49 g/mol
Exact Mass412.19
IUPAC Name6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cccc(-c2ccccc2-c2ccc3ncc(C(=O)NC4CCOCC4)n3c2)n1
InChIInChI=1S/C25H24N4O2/c1-17-5-4-8-22(27-17)21-7-3-2-6-20(21)18-9-10-24-26-15-23(29(24)16-18)25(30)28-19-11-13-31-14-12-19/h2-10,15-16,19H,11-14H2,1H3,(H,28,30)
InChIKeyVCIPDKJIEHPTDC-UHFFFAOYSA-N
XLogP4.28
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.49
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (CID 138706951) is 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is Cc1cccc(-c2ccccc2-c2ccc3ncc(C(=O)NC4CCOCC4)n3c2)n1.
What is the InChIKey of 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is VCIPDKJIEHPTDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O2/c1-17-5-4-8-22(27-17)21-7-3-2-6-20(21)18-9-10-24-26-15-23(29(24)16-18)25(30)28-19-11-13-31-14-12-19/h2-10,15-16,19H,11-14H2,1H3,(H,28,30).
What are the key properties of 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 412.49 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 138706951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).