2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide

C24H24N4OS — CID 40685218

IUPAC2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide
SMILESCSc1ccccc1NC(=O)CN(C)Cc1c(-c2ccccc2)nc2ccccn12
InChIInChI=1S/C24H24N4OS/c1-27(17-23(29)25-19-12-6-7-13-21(19)30-2)16-20-24(18-10-4-3-5-11-18)26-22-14-8-9-15-28(20)22/h3-15H,16-17H2,1-2H3,(H,25,29)
InChIKeyFKYNWVLZWGVIAW-UHFFFAOYSA-N
MW416.55 g/mol
LogP4.79
Rot. Bonds7

About 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide

2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide (PubChem CID 40685218) has the molecular formula C24H24N4OS and a molecular weight of 416.55 g/mol. Its IUPAC name is 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide.

Molecular Properties

Compound Name2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide
PubChem CID40685218
Molecular FormulaC24H24N4OS
Molecular Weight416.55 g/mol
Exact Mass416.17
IUPAC Name2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide
SMILESCSc1ccccc1NC(=O)CN(C)Cc1c(-c2ccccc2)nc2ccccn12
InChIInChI=1S/C24H24N4OS/c1-27(17-23(29)25-19-12-6-7-13-21(19)30-2)16-20-24(18-10-4-3-5-11-18)26-22-14-8-9-15-28(20)22/h3-15H,16-17H2,1-2H3,(H,25,29)
InChIKeyFKYNWVLZWGVIAW-UHFFFAOYSA-N
XLogP4.79
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.55
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide?
The IUPAC name of 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide (CID 40685218) is 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide.
What is the SMILES notation for 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide?
The canonical SMILES for 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide is CSc1ccccc1NC(=O)CN(C)Cc1c(-c2ccccc2)nc2ccccn12.
What is the InChIKey of 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide?
The InChIKey is FKYNWVLZWGVIAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4OS/c1-27(17-23(29)25-19-12-6-7-13-21(19)30-2)16-20-24(18-10-4-3-5-11-18)26-22-14-8-9-15-28(20)22/h3-15H,16-17H2,1-2H3,(H,25,29).
What are the key properties of 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide?
2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide has a molecular weight of 416.55 g/mol, XLogP of 4.79, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-N-(2-methylsulfanylphenyl)acetamide is sourced from PubChem (CID 40685218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).