N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide

C19H15N5O — CID 134551579

IUPACN-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide
SMILESCc1ccncc1NC(=O)c1ccnn2cc(-c3ccccc3)nc12
InChIInChI=1S/C19H15N5O/c1-13-7-9-20-11-16(13)23-19(25)15-8-10-21-24-12-17(22-18(15)24)14-5-3-2-4-6-14/h2-12H,1H3,(H,23,25)
InChIKeyMNIRHKZCFQNAGM-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.35
Rot. Bonds3

About N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide

N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide (PubChem CID 134551579) has the molecular formula C19H15N5O and a molecular weight of 329.36 g/mol. Its IUPAC name is N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide
PubChem CID134551579
Molecular FormulaC19H15N5O
Molecular Weight329.36 g/mol
Exact Mass329.13
IUPAC NameN-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide
SMILESCc1ccncc1NC(=O)c1ccnn2cc(-c3ccccc3)nc12
InChIInChI=1S/C19H15N5O/c1-13-7-9-20-11-16(13)23-19(25)15-8-10-21-24-12-17(22-18(15)24)14-5-3-2-4-6-14/h2-12H,1H3,(H,23,25)
InChIKeyMNIRHKZCFQNAGM-UHFFFAOYSA-N
XLogP3.35
TPSA72.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide?
The IUPAC name of N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide (CID 134551579) is N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide.
What is the SMILES notation for N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide?
The canonical SMILES for N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide is Cc1ccncc1NC(=O)c1ccnn2cc(-c3ccccc3)nc12.
What is the InChIKey of N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide?
The InChIKey is MNIRHKZCFQNAGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O/c1-13-7-9-20-11-16(13)23-19(25)15-8-10-21-24-12-17(22-18(15)24)14-5-3-2-4-6-14/h2-12H,1H3,(H,23,25).
What are the key properties of N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide?
N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-3-pyridinyl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide is sourced from PubChem (CID 134551579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).