2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol

C12H18N2OS — CID 117157914

IUPAC2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
SMILESOC1CCCn2cc(CC3CCCS3)nc21
InChIInChI=1S/C12H18N2OS/c15-11-4-1-5-14-8-9(13-12(11)14)7-10-3-2-6-16-10/h8,10-11,15H,1-7H2
InChIKeyCIJBWSBVDXQLKO-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.15
Rot. Bonds2

About 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol

2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol (PubChem CID 117157914) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol.

Molecular Properties

Compound Name2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
PubChem CID117157914
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC Name2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
SMILESOC1CCCn2cc(CC3CCCS3)nc21
InChIInChI=1S/C12H18N2OS/c15-11-4-1-5-14-8-9(13-12(11)14)7-10-3-2-6-16-10/h8,10-11,15H,1-7H2
InChIKeyCIJBWSBVDXQLKO-UHFFFAOYSA-N
XLogP2.15
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-aminoethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
CID 105439552
2-[(1-propan-2-ylpiperidin-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
CID 117157769
2-[2-(4-methylpiperazin-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
CID 117158259
2-[(1,1-dioxothian-2-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
CID 117157950
2-[(1,1-dioxothiolan-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
CID 117157702
2-(thian-2-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-ol
CID 117157959
2-(thian-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-5-ol
CID 117155520
8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine
CID 117136718
2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carbaldehyde
CID 117129769
2-(5-bromofuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
CID 117158040
(8R)-2-(5-chlorothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
CID 129462756
2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-amine
CID 117157916

Frequently Asked Questions

What is the IUPAC name of 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
The IUPAC name of 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol (CID 117157914) is 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol.
What is the SMILES notation for 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
The canonical SMILES for 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol is OC1CCCn2cc(CC3CCCS3)nc21.
What is the InChIKey of 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
The InChIKey is CIJBWSBVDXQLKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c15-11-4-1-5-14-8-9(13-12(11)14)7-10-3-2-6-16-10/h8,10-11,15H,1-7H2.
What are the key properties of 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol has a molecular weight of 238.36 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiolan-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol is sourced from PubChem (CID 117157914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).