2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide

C14H18N2O2S — CID 117129937

IUPAC2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide
SMILESCc1ccc2nc(CC3CCCCS3(=O)=O)cn2c1
InChIInChI=1S/C14H18N2O2S/c1-11-5-6-14-15-12(10-16(14)9-11)8-13-4-2-3-7-19(13,17)18/h5-6,9-10,13H,2-4,7-8H2,1H3
InChIKeyRHETUDPBBZBFNP-UHFFFAOYSA-N
MW278.38 g/mol
LogP2.15
Rot. Bonds2

About 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide

2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide (PubChem CID 117129937) has the molecular formula C14H18N2O2S and a molecular weight of 278.38 g/mol. Its IUPAC name is 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide.

Molecular Properties

Compound Name2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide
PubChem CID117129937
Molecular FormulaC14H18N2O2S
Molecular Weight278.38 g/mol
Exact Mass278.11
IUPAC Name2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide
SMILESCc1ccc2nc(CC3CCCCS3(=O)=O)cn2c1
InChIInChI=1S/C14H18N2O2S/c1-11-5-6-14-15-12(10-16(14)9-11)8-13-4-2-3-7-19(13,17)18/h5-6,9-10,13H,2-4,7-8H2,1H3
InChIKeyRHETUDPBBZBFNP-UHFFFAOYSA-N
XLogP2.15
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(1,1-dioxothiolan-2-yl)methyl]imidazo[1,2-a]pyridin-6-ol
CID 117129794
2-[(5-chloroimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide
CID 117132170
2-[(8-methoxyimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide
CID 117136792
6-methyl-2-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridine
CID 117129102
2-[(1,1-dioxothian-2-yl)methyl]imidazo[1,2-a]pyridine-8-carbaldehyde
CID 117136819
2-[(1-ethylpyrrolidin-2-yl)methyl]-6-methylimidazo[1,2-a]pyridine
CID 117129834
2-[(1,1-dioxothian-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
CID 117157950
2-[methyl-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]cyclohexan-1-ol
CID 102636372
1-cyclopentyl-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]imidazolidine-2,4,5-trione
CID 4788304
2-[(1,1-dioxothian-4-yl)methyl]imidazo[1,2-a]pyridin-6-ol
CID 117129225
2-methyl-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide
CID 47342907
2-[cyclopropylmethyl-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid
CID 43656513

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide?
The IUPAC name of 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide (CID 117129937) is 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide.
What is the SMILES notation for 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide?
The canonical SMILES for 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide is Cc1ccc2nc(CC3CCCCS3(=O)=O)cn2c1.
What is the InChIKey of 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide?
The InChIKey is RHETUDPBBZBFNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S/c1-11-5-6-14-15-12(10-16(14)9-11)8-13-4-2-3-7-19(13,17)18/h5-6,9-10,13H,2-4,7-8H2,1H3.
What are the key properties of 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide?
2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide has a molecular weight of 278.38 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thiane 1,1-dioxide is sourced from PubChem (CID 117129937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).