N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide

C17H19N3OS — CID 13259005

IUPACN,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide
SMILESCc1ccc2nc(-c3ccc(C)s3)c(CC(=O)N(C)C)n2c1
InChIInChI=1S/C17H19N3OS/c1-11-5-8-15-18-17(14-7-6-12(2)22-14)13(20(15)10-11)9-16(21)19(3)4/h5-8,10H,9H2,1-4H3
InChIKeyOGAMKXQREDIZCY-UHFFFAOYSA-N
MW313.43 g/mol
LogP3.31
Rot. Bonds3

About N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide

N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide (PubChem CID 13259005) has the molecular formula C17H19N3OS and a molecular weight of 313.43 g/mol. Its IUPAC name is N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide
PubChem CID13259005
Molecular FormulaC17H19N3OS
Molecular Weight313.43 g/mol
Exact Mass313.12
IUPAC NameN,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide
SMILESCc1ccc2nc(-c3ccc(C)s3)c(CC(=O)N(C)C)n2c1
InChIInChI=1S/C17H19N3OS/c1-11-5-8-15-18-17(14-7-6-12(2)22-14)13(20(15)10-11)9-16(21)19(3)4/h5-8,10H,9H2,1-4H3
InChIKeyOGAMKXQREDIZCY-UHFFFAOYSA-N
XLogP3.31
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.43
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide?
The IUPAC name of N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide (CID 13259005) is N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide is Cc1ccc2nc(-c3ccc(C)s3)c(CC(=O)N(C)C)n2c1.
What is the InChIKey of N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide?
The InChIKey is OGAMKXQREDIZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3OS/c1-11-5-8-15-18-17(14-7-6-12(2)22-14)13(20(15)10-11)9-16(21)19(3)4/h5-8,10H,9H2,1-4H3.
What are the key properties of N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide?
N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide has a molecular weight of 313.43 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[6-methyl-2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-yl]acetamide is sourced from PubChem (CID 13259005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).