trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide

C7H8BN2O3- — CID 91662880

IUPACtrihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide
SMILESO[B-](O)(O)c1cccc2nccn12
InChIInChI=1S/C7H8BN2O3/c11-8(12,13)6-2-1-3-7-9-4-5-10(6)7/h1-5,11-13H/q-1
InChIKeyIKKCFJNCNPXVPB-UHFFFAOYSA-N
MW178.96 g/mol
LogP-1.54
Rot. Bonds1

About trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide

trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide (PubChem CID 91662880) has the molecular formula C7H8BN2O3- and a molecular weight of 178.96 g/mol. Its IUPAC name is trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide.

Molecular Properties

Compound Nametrihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide
PubChem CID91662880
Molecular FormulaC7H8BN2O3-
Molecular Weight178.96 g/mol
Exact Mass179.06
IUPAC Nametrihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide
SMILESO[B-](O)(O)c1cccc2nccn12
InChIInChI=1S/C7H8BN2O3/c11-8(12,13)6-2-1-3-7-9-4-5-10(6)7/h1-5,11-13H/q-1
InChIKeyIKKCFJNCNPXVPB-UHFFFAOYSA-N
XLogP-1.54
TPSA77.99 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.96
LogP ≤ 5-1.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

1-imidazo[1,2-a]pyridin-5-ylethanone
CID 82596119
imidazo[1,2-a]pyridin-5-ylmethanethiol
CID 89093379
N,N-dimethylimidazo[1,2-a]pyridin-5-amine
CID 130557663
5-(bromomethyl)imidazo[1,2-a]pyridine;hydrobromide
CID 121232171
2-(imidazo[1,2-a]pyridin-5-ylamino)propan-1-ol
CID 102625375
1-amino-1-imidazo[1,2-a]pyridin-5-ylpropan-2-ol
CID 82403390
3-imidazo[1,2-a]pyridin-5-ylbenzamide
CID 46948491
ethane;5-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 142047032
2-(imidazo[1,2-a]pyridin-5-ylamino)acetic acid
CID 162696041
3-amino-2-imidazo[1,2-a]pyridin-5-ylpropan-1-ol
CID 102627018
5-imidazo[1,2-a]pyridin-5-ylpyrimidin-2-amine
CID 102626318
2-imidazo[1,2-a]pyridin-5-ylaniline
CID 102626302

Frequently Asked Questions

What is the IUPAC name of trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide?
The IUPAC name of trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide (CID 91662880) is trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide.
What is the SMILES notation for trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide?
The canonical SMILES for trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide is O[B-](O)(O)c1cccc2nccn12.
What is the InChIKey of trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide?
The InChIKey is IKKCFJNCNPXVPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BN2O3/c11-8(12,13)6-2-1-3-7-9-4-5-10(6)7/h1-5,11-13H/q-1.
What are the key properties of trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide?
trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide has a molecular weight of 178.96 g/mol, XLogP of -1.54, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy(imidazo[1,2-a]pyridin-5-yl)boranuide is sourced from PubChem (CID 91662880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).