N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine

C20H22N6O — CID 166793924

IUPACN-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine
SMILESCN(c1ccc2ncc(-c3ccc4c(cnn4C)c3)n2n1)C1CCOCC1
InChIInChI=1S/C20H22N6O/c1-24(16-7-9-27-10-8-16)20-6-5-19-21-13-18(26(19)23-20)14-3-4-17-15(11-14)12-22-25(17)2/h3-6,11-13,16H,7-10H2,1-2H3
InChIKeyGPTYWHUYTGZSSI-UHFFFAOYSA-N
MW362.44 g/mol
LogP2.90
Rot. Bonds3

About N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine

N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine (PubChem CID 166793924) has the molecular formula C20H22N6O and a molecular weight of 362.44 g/mol. Its IUPAC name is N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine
PubChem CID166793924
Molecular FormulaC20H22N6O
Molecular Weight362.44 g/mol
Exact Mass362.19
IUPAC NameN-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine
SMILESCN(c1ccc2ncc(-c3ccc4c(cnn4C)c3)n2n1)C1CCOCC1
InChIInChI=1S/C20H22N6O/c1-24(16-7-9-27-10-8-16)20-6-5-19-21-13-18(26(19)23-20)14-3-4-17-15(11-14)12-22-25(17)2/h3-6,11-13,16H,7-10H2,1-2H3
InChIKeyGPTYWHUYTGZSSI-UHFFFAOYSA-N
XLogP2.90
TPSA60.48 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.44
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

3-(1H-indazol-5-yl)-6-(oxan-4-yloxy)imidazo[1,2-b]pyridazine
CID 163429926
3-[1-(oxan-2-yl)indazol-5-yl]-N-propylimidazo[1,2-b]pyridazin-6-amine
CID 118703524
N-(6-chloro-3-pyridinyl)-N-methyl-3-(1-methylindazol-5-yl)imidazo[1,2-a]pyrazine-6-carboxamide
CID 90157332
1-[5-[6-[2-[methyl(oxan-4-yl)amino]ethyl]imidazo[1,2-b]pyridazin-3-yl]-1H-indazol-3-yl]ethanone
CID 168759843
4-[6-(oxan-4-ylamino)imidazo[1,2-b]pyridazin-3-yl]phenol
CID 135923073
3-bromo-N-(4,4-difluorocyclohexyl)-N-methylimidazo[1,2-b]pyridazin-6-amine
CID 166793725
4-[6-(oxan-4-yloxy)imidazo[1,2-b]pyridazin-3-yl]benzonitrile
CID 66890326
6-[methyl(oxan-4-yl)amino]pyridine-3-carboxylic acid
CID 43611328
3-[4-ethanimidoyl-3-(methylamino)phenyl]-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine
CID 166806973
1-[3-[6-(oxan-4-ylamino)imidazo[1,2-b]pyridazin-3-yl]phenyl]propan-2-one
CID 140905496
N-(4,4-dimethylcyclohexyl)-N-methyl-3-nitroimidazo[1,2-b]pyridazin-6-amine
CID 133419553
N-methyl-3-naphthalen-2-yl-N-(2-pyridin-2-ylethyl)imidazo[1,2-b]pyridazin-6-amine
CID 58857791

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine?
The IUPAC name of N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine (CID 166793924) is N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine.
What is the SMILES notation for N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine?
The canonical SMILES for N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine is CN(c1ccc2ncc(-c3ccc4c(cnn4C)c3)n2n1)C1CCOCC1.
What is the InChIKey of N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine?
The InChIKey is GPTYWHUYTGZSSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N6O/c1-24(16-7-9-27-10-8-16)20-6-5-19-21-13-18(26(19)23-20)14-3-4-17-15(11-14)12-22-25(17)2/h3-6,11-13,16H,7-10H2,1-2H3.
What are the key properties of N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine?
N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine has a molecular weight of 362.44 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(1-methylindazol-5-yl)-N-(oxan-4-yl)imidazo[1,2-b]pyridazin-6-amine is sourced from PubChem (CID 166793924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).