3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide

C8H9N3O — CID 91595014

IUPAC3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide
SMILESNC(=O)C1=CN2CC=NC2C=C1
InChIInChI=1S/C8H9N3O/c9-8(12)6-1-2-7-10-3-4-11(7)5-6/h1-3,5,7H,4H2,(H2,9,12)
InChIKeyVHTYPZNRIPGVTG-UHFFFAOYSA-N
MW163.18 g/mol
LogP-0.36
Rot. Bonds1

About 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide

3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 91595014) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID91595014
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide
SMILESNC(=O)C1=CN2CC=NC2C=C1
InChIInChI=1S/C8H9N3O/c9-8(12)6-1-2-7-10-3-4-11(7)5-6/h1-3,5,7H,4H2,(H2,9,12)
InChIKeyVHTYPZNRIPGVTG-UHFFFAOYSA-N
XLogP-0.36
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide (CID 91595014) is 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide is NC(=O)C1=CN2CC=NC2C=C1.
What is the InChIKey of 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is VHTYPZNRIPGVTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c9-8(12)6-1-2-7-10-3-4-11(7)5-6/h1-3,5,7H,4H2,(H2,9,12).
What are the key properties of 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide?
3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 163.18 g/mol, XLogP of -0.36, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8a-dihydroimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 91595014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).