1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one

C8H9N3O — CID 137437063

IUPAC1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one
SMILESCNc1[nH]c(=O)n2ccccc12
InChIInChI=1S/C8H9N3O/c1-9-7-6-4-2-3-5-11(6)8(12)10-7/h2-5,9H,1H3,(H,10,12)
InChIKeyFZNHADFQNWXSLP-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.67
Rot. Bonds1

About 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one

1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one (PubChem CID 137437063) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one.

Molecular Properties

Compound Name1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one
PubChem CID137437063
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one
SMILESCNc1[nH]c(=O)n2ccccc12
InChIInChI=1S/C8H9N3O/c1-9-7-6-4-2-3-5-11(6)8(12)10-7/h2-5,9H,1H3,(H,10,12)
InChIKeyFZNHADFQNWXSLP-UHFFFAOYSA-N
XLogP0.67
TPSA49.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one?
The IUPAC name of 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one (CID 137437063) is 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one.
What is the SMILES notation for 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one?
The canonical SMILES for 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one is CNc1[nH]c(=O)n2ccccc12.
What is the InChIKey of 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one?
The InChIKey is FZNHADFQNWXSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-9-7-6-4-2-3-5-11(6)8(12)10-7/h2-5,9H,1H3,(H,10,12).
What are the key properties of 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one?
1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one has a molecular weight of 163.18 g/mol, XLogP of 0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-2H-imidazo[1,5-a]pyridin-3-one is sourced from PubChem (CID 137437063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).