2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide

C18H21N3OS — CID 13259006

IUPAC2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide
SMILESCCc1ccc(-c2nc3ccc(C)cn3c2CC(=O)N(C)C)s1
InChIInChI=1S/C18H21N3OS/c1-5-13-7-8-15(23-13)18-14(10-17(22)20(3)4)21-11-12(2)6-9-16(21)19-18/h6-9,11H,5,10H2,1-4H3
InChIKeyHYFZRNJCPVONRW-UHFFFAOYSA-N
MW327.45 g/mol
LogP3.56
Rot. Bonds4

About 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide

2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide (PubChem CID 13259006) has the molecular formula C18H21N3OS and a molecular weight of 327.45 g/mol. Its IUPAC name is 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide
PubChem CID13259006
Molecular FormulaC18H21N3OS
Molecular Weight327.45 g/mol
Exact Mass327.14
IUPAC Name2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide
SMILESCCc1ccc(-c2nc3ccc(C)cn3c2CC(=O)N(C)C)s1
InChIInChI=1S/C18H21N3OS/c1-5-13-7-8-15(23-13)18-14(10-17(22)20(3)4)21-11-12(2)6-9-16(21)19-18/h6-9,11H,5,10H2,1-4H3
InChIKeyHYFZRNJCPVONRW-UHFFFAOYSA-N
XLogP3.56
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.45
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide?
The IUPAC name of 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide (CID 13259006) is 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide?
The canonical SMILES for 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide is CCc1ccc(-c2nc3ccc(C)cn3c2CC(=O)N(C)C)s1.
What is the InChIKey of 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide?
The InChIKey is HYFZRNJCPVONRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3OS/c1-5-13-7-8-15(23-13)18-14(10-17(22)20(3)4)21-11-12(2)6-9-16(21)19-18/h6-9,11H,5,10H2,1-4H3.
What are the key properties of 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide?
2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide has a molecular weight of 327.45 g/mol, XLogP of 3.56, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-ethylthiophen-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide is sourced from PubChem (CID 13259006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).