N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine

C24H21N5 — CID 58857791

IUPACN-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine
SMILESCN(CCc1ccccn1)c1ccc2ncc(-c3ccc4ccccc4c3)n2n1
InChIInChI=1S/C24H21N5/c1-28(15-13-21-8-4-5-14-25-21)24-12-11-23-26-17-22(29(23)27-24)20-10-9-18-6-2-3-7-19(18)16-20/h2-12,14,16-17H,13,15H2,1H3
InChIKeyKAJSMWKTDKGRTE-UHFFFAOYSA-N
MW379.47 g/mol
LogP4.62
Rot. Bonds5

About N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine

N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine (PubChem CID 58857791) has the molecular formula C24H21N5 and a molecular weight of 379.47 g/mol. Its IUPAC name is N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine
PubChem CID58857791
Molecular FormulaC24H21N5
Molecular Weight379.47 g/mol
Exact Mass379.18
IUPAC NameN-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine
SMILESCN(CCc1ccccn1)c1ccc2ncc(-c3ccc4ccccc4c3)n2n1
InChIInChI=1S/C24H21N5/c1-28(15-13-21-8-4-5-14-25-21)24-12-11-23-26-17-22(29(23)27-24)20-10-9-18-6-2-3-7-19(18)16-20/h2-12,14,16-17H,13,15H2,1H3
InChIKeyKAJSMWKTDKGRTE-UHFFFAOYSA-N
XLogP4.62
TPSA46.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.47
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine?
The IUPAC name of N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine (CID 58857791) is N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine.
What is the SMILES notation for N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine?
The canonical SMILES for N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine is CN(CCc1ccccn1)c1ccc2ncc(-c3ccc4ccccc4c3)n2n1.
What is the InChIKey of N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine?
The InChIKey is KAJSMWKTDKGRTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5/c1-28(15-13-21-8-4-5-14-25-21)24-12-11-23-26-17-22(29(23)27-24)20-10-9-18-6-2-3-7-19(18)16-20/h2-12,14,16-17H,13,15H2,1H3.
What are the key properties of N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine?
N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine has a molecular weight of 379.47 g/mol, XLogP of 4.62, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine is sourced from PubChem (CID 58857791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).