1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide

C24H25N5O2 — CID 24889840

IUPAC1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide
SMILESCc1cccc(C)c1CNc1cc(-n2cc(C(N)=O)ccc2=O)cn2c(C)c(C)nc12
InChIInChI=1S/C24H25N5O2/c1-14-6-5-7-15(2)20(14)11-26-21-10-19(13-28-17(4)16(3)27-24(21)28)29-12-18(23(25)31)8-9-22(29)30/h5-10,12-13,26H,11H2,1-4H3,(H2,25,31)
InChIKeyXSQBHUDKEMPJMV-UHFFFAOYSA-N
MW415.50 g/mol
LogP3.43
Rot. Bonds5

About 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide

1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide (PubChem CID 24889840) has the molecular formula C24H25N5O2 and a molecular weight of 415.50 g/mol. Its IUPAC name is 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide
PubChem CID24889840
Molecular FormulaC24H25N5O2
Molecular Weight415.50 g/mol
Exact Mass415.20
IUPAC Name1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide
SMILESCc1cccc(C)c1CNc1cc(-n2cc(C(N)=O)ccc2=O)cn2c(C)c(C)nc12
InChIInChI=1S/C24H25N5O2/c1-14-6-5-7-15(2)20(14)11-26-21-10-19(13-28-17(4)16(3)27-24(21)28)29-12-18(23(25)31)8-9-22(29)30/h5-10,12-13,26H,11H2,1-4H3,(H2,25,31)
InChIKeyXSQBHUDKEMPJMV-UHFFFAOYSA-N
XLogP3.43
TPSA94.42 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.50
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide?
The IUPAC name of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide (CID 24889840) is 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide is Cc1cccc(C)c1CNc1cc(-n2cc(C(N)=O)ccc2=O)cn2c(C)c(C)nc12.
What is the InChIKey of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide?
The InChIKey is XSQBHUDKEMPJMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O2/c1-14-6-5-7-15(2)20(14)11-26-21-10-19(13-28-17(4)16(3)27-24(21)28)29-12-18(23(25)31)8-9-22(29)30/h5-10,12-13,26H,11H2,1-4H3,(H2,25,31).
What are the key properties of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide?
1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide has a molecular weight of 415.50 g/mol, XLogP of 3.43, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 24889840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).