2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol

C13H17N3OS — CID 117159877

IUPAC2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol
SMILESOCCc1nc2cccnc2n1C1CCCCS1
InChIInChI=1S/C13H17N3OS/c17-8-6-11-15-10-4-3-7-14-13(10)16(11)12-5-1-2-9-18-12/h3-4,7,12,17H,1-2,5-6,8-9H2
InChIKeyRFTRNOMNVVVLGI-UHFFFAOYSA-N
MW263.37 g/mol
LogP2.38
Rot. Bonds3

About 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol

2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol (PubChem CID 117159877) has the molecular formula C13H17N3OS and a molecular weight of 263.37 g/mol. Its IUPAC name is 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol.

Molecular Properties

Compound Name2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol
PubChem CID117159877
Molecular FormulaC13H17N3OS
Molecular Weight263.37 g/mol
Exact Mass263.11
IUPAC Name2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol
SMILESOCCc1nc2cccnc2n1C1CCCCS1
InChIInChI=1S/C13H17N3OS/c17-8-6-11-15-10-4-3-7-14-13(10)16(11)12-5-1-2-9-18-12/h3-4,7,12,17H,1-2,5-6,8-9H2
InChIKeyRFTRNOMNVVVLGI-UHFFFAOYSA-N
XLogP2.38
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol 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-methylpiperidin-2-yl)methyl]-3-(thiolan-2-yl)imidazo[4,5-b]pyridine
CID 117163675
2-[3-(1-ethylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol
CID 117159869
2-[(3-methylphenyl)methyl]-3-(thiolan-2-yl)imidazo[4,5-b]pyridine
CID 117164957
2-[3-(1-propan-2-ylpiperidin-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol
CID 117159884
2-(3-fluorophenyl)-3-(thian-2-yl)imidazo[4,5-b]pyridine
CID 117166710
2-(oxan-4-yl)-3-(thiolan-2-yl)imidazo[4,5-b]pyridine
CID 117160752
2-[3-(thiolan-3-ylmethyl)imidazo[4,5-b]pyridin-2-yl]ethanol
CID 117159822
2-(3-cycloheptylimidazo[4,5-b]pyridin-2-yl)ethanamine
CID 82483690
3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159557
3-piperidin-2-yl-2-(thian-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117163688
3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159614
3-[3-(1-propan-2-ylpiperidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159631

Frequently Asked Questions

What is the IUPAC name of 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol?
The IUPAC name of 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol (CID 117159877) is 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol.
What is the SMILES notation for 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol?
The canonical SMILES for 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol is OCCc1nc2cccnc2n1C1CCCCS1.
What is the InChIKey of 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol?
The InChIKey is RFTRNOMNVVVLGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3OS/c17-8-6-11-15-10-4-3-7-14-13(10)16(11)12-5-1-2-9-18-12/h3-4,7,12,17H,1-2,5-6,8-9H2.
What are the key properties of 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol?
2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol has a molecular weight of 263.37 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(thian-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol is sourced from PubChem (CID 117159877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).