[2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol

C19H16N2O2S — CID 134132602

IUPAC[2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol
SMILESOCc1ccc(-c2nc(-c3ccccc3CO)c3ccccn23)s1
InChIInChI=1S/C19H16N2O2S/c22-11-13-5-1-2-6-15(13)18-16-7-3-4-10-21(16)19(20-18)17-9-8-14(12-23)24-17/h1-10,22-23H,11-12H2
InChIKeyRUSRKTMSFAJPJW-UHFFFAOYSA-N
MW336.42 g/mol
LogP3.71
Rot. Bonds4

About [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol

[2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol (PubChem CID 134132602) has the molecular formula C19H16N2O2S and a molecular weight of 336.42 g/mol. Its IUPAC name is [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol.

Molecular Properties

Compound Name[2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol
PubChem CID134132602
Molecular FormulaC19H16N2O2S
Molecular Weight336.42 g/mol
Exact Mass336.09
IUPAC Name[2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol
SMILESOCc1ccc(-c2nc(-c3ccccc3CO)c3ccccn23)s1
InChIInChI=1S/C19H16N2O2S/c22-11-13-5-1-2-6-15(13)18-16-7-3-4-10-21(16)19(20-18)17-9-8-14(12-23)24-17/h1-10,22-23H,11-12H2
InChIKeyRUSRKTMSFAJPJW-UHFFFAOYSA-N
XLogP3.71
TPSA57.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

CID 25093438
CID 25093438
CID 25093439
CID 25093439
CID 25093440
CID 25093440
CID 25093441
CID 25093441
CID 117769781
CID 117769781
CID 126673064
CID 126673064
CID 126673302
CID 126673302
CID 138619388
CID 138619388
CID 49795840
CID 49795840
CID 53322663
CID 53322663
CID 134142080
CID 134142080
CID 134149171
CID 134149171

Frequently Asked Questions

What is the IUPAC name of [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol?
The IUPAC name of [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol (CID 134132602) is [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol.
What is the SMILES notation for [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol?
The canonical SMILES for [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol is OCc1ccc(-c2nc(-c3ccccc3CO)c3ccccn23)s1.
What is the InChIKey of [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol?
The InChIKey is RUSRKTMSFAJPJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2S/c22-11-13-5-1-2-6-15(13)18-16-7-3-4-10-21(16)19(20-18)17-9-8-14(12-23)24-17/h1-10,22-23H,11-12H2.
What are the key properties of [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol?
[2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol has a molecular weight of 336.42 g/mol, XLogP of 3.71, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[3-[5-(hydroxymethyl)thiophen-2-yl]imidazo[1,5-a]pyridin-1-yl]phenyl]methanol is sourced from PubChem (CID 134132602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).