2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one

C15H17N5O — CID 103220136

IUPAC2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one
SMILESCCCNc1cnn(Cc2cn3ccccc3n2)c(=O)c1
InChIInChI=1S/C15H17N5O/c1-2-6-16-12-8-15(21)20(17-9-12)11-13-10-19-7-4-3-5-14(19)18-13/h3-5,7-10,16H,2,6,11H2,1H3
InChIKeyFVXJMQOLYDRAMN-UHFFFAOYSA-N
MW283.33 g/mol
LogP1.76
Rot. Bonds5

About 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one

2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one (PubChem CID 103220136) has the molecular formula C15H17N5O and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one.

Molecular Properties

Compound Name2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one
PubChem CID103220136
Molecular FormulaC15H17N5O
Molecular Weight283.33 g/mol
Exact Mass283.14
IUPAC Name2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one
SMILESCCCNc1cnn(Cc2cn3ccccc3n2)c(=O)c1
InChIInChI=1S/C15H17N5O/c1-2-6-16-12-8-15(21)20(17-9-12)11-13-10-19-7-4-3-5-14(19)18-13/h3-5,7-10,16H,2,6,11H2,1H3
InChIKeyFVXJMQOLYDRAMN-UHFFFAOYSA-N
XLogP1.76
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one?
The IUPAC name of 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one (CID 103220136) is 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one.
What is the SMILES notation for 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one?
The canonical SMILES for 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one is CCCNc1cnn(Cc2cn3ccccc3n2)c(=O)c1.
What is the InChIKey of 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one?
The InChIKey is FVXJMQOLYDRAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c1-2-6-16-12-8-15(21)20(17-9-12)11-13-10-19-7-4-3-5-14(19)18-13/h3-5,7-10,16H,2,6,11H2,1H3.
What are the key properties of 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one?
2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one has a molecular weight of 283.33 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-(propylamino)pyridazin-3-one is sourced from PubChem (CID 103220136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).