8-deuterio-1H-imidazo[1,2-a]pyridin-5-one

C7H6N2O — CID 59374855

IUPAC8-deuterio-1H-imidazo[1,2-a]pyridin-5-one
SMILES[2H]c1ccc(=O)n2cc[nH]c12
InChIInChI=1S/C7H6N2O/c10-7-3-1-2-6-8-4-5-9(6)7/h1-5,8H/i2D
InChIKeyFRNQSRVHYJCNHW-VMNATFBRSA-N
MW135.14 g/mol
LogP0.63
Rot. Bonds

About 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one

8-deuterio-1H-imidazo[1,2-a]pyridin-5-one (PubChem CID 59374855) has the molecular formula C7H6N2O and a molecular weight of 135.14 g/mol. Its IUPAC name is 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one.

Molecular Properties

Compound Name8-deuterio-1H-imidazo[1,2-a]pyridin-5-one
PubChem CID59374855
Molecular FormulaC7H6N2O
Molecular Weight135.14 g/mol
Exact Mass135.05
IUPAC Name8-deuterio-1H-imidazo[1,2-a]pyridin-5-one
SMILES[2H]c1ccc(=O)n2cc[nH]c12
InChIInChI=1S/C7H6N2O/c10-7-3-1-2-6-8-4-5-9(6)7/h1-5,8H/i2D
InChIKeyFRNQSRVHYJCNHW-VMNATFBRSA-N
XLogP0.63
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one?
The IUPAC name of 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one (CID 59374855) is 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one.
What is the SMILES notation for 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one?
The canonical SMILES for 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one is [2H]c1ccc(=O)n2cc[nH]c12.
What is the InChIKey of 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one?
The InChIKey is FRNQSRVHYJCNHW-VMNATFBRSA-N. The full InChI is InChI=1S/C7H6N2O/c10-7-3-1-2-6-8-4-5-9(6)7/h1-5,8H/i2D.
What are the key properties of 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one?
8-deuterio-1H-imidazo[1,2-a]pyridin-5-one has a molecular weight of 135.14 g/mol, XLogP of 0.63, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-deuterio-1H-imidazo[1,2-a]pyridin-5-one is sourced from PubChem (CID 59374855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).