[5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol

C17H13N3OS — CID 134149171

IUPAC[5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol
SMILESOCc1ccc(-c2nc(-c3ccncc3)c3ccccn23)s1
InChIInChI=1S/C17H13N3OS/c21-11-13-4-5-15(22-13)17-19-16(12-6-8-18-9-7-12)14-3-1-2-10-20(14)17/h1-10,21H,11H2
InChIKeyVXBDITGRZABHAT-UHFFFAOYSA-N
MW307.38 g/mol
LogP3.62
Rot. Bonds3

About [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol

[5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol (PubChem CID 134149171) has the molecular formula C17H13N3OS and a molecular weight of 307.38 g/mol. Its IUPAC name is [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol.

Molecular Properties

Compound Name[5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol
PubChem CID134149171
Molecular FormulaC17H13N3OS
Molecular Weight307.38 g/mol
Exact Mass307.08
IUPAC Name[5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol
SMILESOCc1ccc(-c2nc(-c3ccncc3)c3ccccn23)s1
InChIInChI=1S/C17H13N3OS/c21-11-13-4-5-15(22-13)17-19-16(12-6-8-18-9-7-12)14-3-1-2-10-20(14)17/h1-10,21H,11H2
InChIKeyVXBDITGRZABHAT-UHFFFAOYSA-N
XLogP3.62
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-Methyl-2-[5-(2-pyridinyl)-2-thienyl]imidazo[1,2-a]pyridine
CID 2813457
(2-{8-[(2-Aminoethyl)amino]-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-4-yl}phenyl)methanol
CID 25093438
(3-{8-[(2-Aminoethyl)amino]-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-4-yl}phenyl)methanol
CID 25093439
(4-{8-[(2-Aminoethyl)amino]-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-4-yl}phenyl)methanol
CID 25093440
2-(3-{8-[(2-Aminoethyl)amino]-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-4-yl}phenyl)ethan-1-ol
CID 25093441
4-[(5-Thiophen-2-ylimidazo[4,5-b]pyrazin-3-yl)methyl]phenol
CID 11347373
3-[6-(2-Thienyl)imidazo [1,2-a]pyrazin-3-yl]phenol
CID 117769781
[3-[3-(2-Thienyl)imidazo [1,2-b]pyridazin-6-yl]phenyl] methanol
CID 126673064
4-[3-(3-Thienyl)imidazo [1,2-a]pyrazin-6-yl]phenol
CID 126673302
(1R)-1-phenyl-2-[[4-[4-[[(3R)-pyrrolidin-3-yl]amino]thieno[3,2-d]pyrimidin-2-yl]-2-pyridinyl]amino]ethanol
CID 89596372
3-(5-methylpyrazin-2-yl)-7-[[5-(oxan-2-yl)thiophen-2-yl]methyl]-1-phenyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 45160591
(4-Imidazo[2,1-b][1,3]benzothiazol-2-ylphenyl)methanol
CID 53322663

Frequently Asked Questions

What is the IUPAC name of [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol?
The IUPAC name of [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol (CID 134149171) is [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol.
What is the SMILES notation for [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol?
The canonical SMILES for [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol is OCc1ccc(-c2nc(-c3ccncc3)c3ccccn23)s1.
What is the InChIKey of [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol?
The InChIKey is VXBDITGRZABHAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3OS/c21-11-13-4-5-15(22-13)17-19-16(12-6-8-18-9-7-12)14-3-1-2-10-20(14)17/h1-10,21H,11H2.
What are the key properties of [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol?
[5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol has a molecular weight of 307.38 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-pyridin-4-ylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol is sourced from PubChem (CID 134149171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).