4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide

C22H21N3O2S — CID 16612941

IUPAC4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide
SMILESCc1cccn2cc(COc3ccc(C(=O)NCCc4cccs4)cc3)nc12
InChIInChI=1S/C22H21N3O2S/c1-16-4-2-12-25-14-18(24-21(16)25)15-27-19-8-6-17(7-9-19)22(26)23-11-10-20-5-3-13-28-20/h2-9,12-14H,10-11,15H2,1H3,(H,23,26)
InChIKeyKTBZTIMZGOGUGG-UHFFFAOYSA-N
MW391.50 g/mol
LogP4.26
Rot. Bonds7

About 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide

4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide (PubChem CID 16612941) has the molecular formula C22H21N3O2S and a molecular weight of 391.50 g/mol. Its IUPAC name is 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide.

Molecular Properties

Compound Name4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide
PubChem CID16612941
Molecular FormulaC22H21N3O2S
Molecular Weight391.50 g/mol
Exact Mass391.14
IUPAC Name4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide
SMILESCc1cccn2cc(COc3ccc(C(=O)NCCc4cccs4)cc3)nc12
InChIInChI=1S/C22H21N3O2S/c1-16-4-2-12-25-14-18(24-21(16)25)15-27-19-8-6-17(7-9-19)22(26)23-11-10-20-5-3-13-28-20/h2-9,12-14H,10-11,15H2,1H3,(H,23,26)
InChIKeyKTBZTIMZGOGUGG-UHFFFAOYSA-N
XLogP4.26
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.50
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide?
The IUPAC name of 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide (CID 16612941) is 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide.
What is the SMILES notation for 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide?
The canonical SMILES for 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide is Cc1cccn2cc(COc3ccc(C(=O)NCCc4cccs4)cc3)nc12.
What is the InChIKey of 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide?
The InChIKey is KTBZTIMZGOGUGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2S/c1-16-4-2-12-25-14-18(24-21(16)25)15-27-19-8-6-17(7-9-19)22(26)23-11-10-20-5-3-13-28-20/h2-9,12-14H,10-11,15H2,1H3,(H,23,26).
What are the key properties of 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide?
4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide has a molecular weight of 391.50 g/mol, XLogP of 4.26, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(2-thiophen-2-ylethyl)benzamide is sourced from PubChem (CID 16612941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).