[1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid

C10H11N6O4P — CID 67940771

IUPAC[1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid
SMILESO=P(O)(O)C(O)Cc1ccc2nc(-c3nn[nH]n3)cn2c1
InChIInChI=1S/C10H11N6O4P/c17-9(21(18,19)20)3-6-1-2-8-11-7(5-16(8)4-6)10-12-14-15-13-10/h1-2,4-5,9,17H,3H2,(H2,18,19,20)(H,12,13,14,15)
InChIKeyRLEPWFZOSNPCBJ-UHFFFAOYSA-N
MW310.21 g/mol
LogP-0.45
Rot. Bonds4

About [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid

[1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid (PubChem CID 67940771) has the molecular formula C10H11N6O4P and a molecular weight of 310.21 g/mol. Its IUPAC name is [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid.

Molecular Properties

Compound Name[1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid
PubChem CID67940771
Molecular FormulaC10H11N6O4P
Molecular Weight310.21 g/mol
Exact Mass310.06
IUPAC Name[1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid
SMILESO=P(O)(O)C(O)Cc1ccc2nc(-c3nn[nH]n3)cn2c1
InChIInChI=1S/C10H11N6O4P/c17-9(21(18,19)20)3-6-1-2-8-11-7(5-16(8)4-6)10-12-14-15-13-10/h1-2,4-5,9,17H,3H2,(H2,18,19,20)(H,12,13,14,15)
InChIKeyRLEPWFZOSNPCBJ-UHFFFAOYSA-N
XLogP-0.45
TPSA149.52 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.21
LogP ≤ 5-0.45
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid?
The IUPAC name of [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid (CID 67940771) is [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid.
What is the SMILES notation for [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid?
The canonical SMILES for [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid is O=P(O)(O)C(O)Cc1ccc2nc(-c3nn[nH]n3)cn2c1.
What is the InChIKey of [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid?
The InChIKey is RLEPWFZOSNPCBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N6O4P/c17-9(21(18,19)20)3-6-1-2-8-11-7(5-16(8)4-6)10-12-14-15-13-10/h1-2,4-5,9,17H,3H2,(H2,18,19,20)(H,12,13,14,15).
What are the key properties of [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid?
[1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid has a molecular weight of 310.21 g/mol, XLogP of -0.45, 4 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-hydroxy-2-[2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridin-6-yl]ethyl]phosphonic acid is sourced from PubChem (CID 67940771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).