6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide

C23H24N6O2 — CID 144795157

IUPAC6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide
SMILESCc1nc(-c2cccc(NC(=O)c3cnc4ccc(NC5CCCCC5)nn34)c2)co1
InChIInChI=1S/C23H24N6O2/c1-15-25-19(14-31-15)16-6-5-9-18(12-16)27-23(30)20-13-24-22-11-10-21(28-29(20)22)26-17-7-3-2-4-8-17/h5-6,9-14,17H,2-4,7-8H2,1H3,(H,26,28)(H,27,30)
InChIKeyNMWVLFJIQACFGZ-UHFFFAOYSA-N
MW416.49 g/mol
LogP4.69
Rot. Bonds5

About 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide

6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide (PubChem CID 144795157) has the molecular formula C23H24N6O2 and a molecular weight of 416.49 g/mol. Its IUPAC name is 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide
PubChem CID144795157
Molecular FormulaC23H24N6O2
Molecular Weight416.49 g/mol
Exact Mass416.20
IUPAC Name6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide
SMILESCc1nc(-c2cccc(NC(=O)c3cnc4ccc(NC5CCCCC5)nn34)c2)co1
InChIInChI=1S/C23H24N6O2/c1-15-25-19(14-31-15)16-6-5-9-18(12-16)27-23(30)20-13-24-22-11-10-21(28-29(20)22)26-17-7-3-2-4-8-17/h5-6,9-14,17H,2-4,7-8H2,1H3,(H,26,28)(H,27,30)
InChIKeyNMWVLFJIQACFGZ-UHFFFAOYSA-N
XLogP4.69
TPSA97.35 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.49
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

8-anilino-6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 144795147
3-[6-(cyclohexylamino)imidazo[1,2-b]pyridazin-3-yl]benzoic acid
CID 25102960
6-(cyclohexylamino)-8-(methylamino)-N-[3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 144795152
6-(cyclohexylamino)-8-(methylamino)-N-[3-(5-propan-2-yl-2,5-dihydro-1,2,4-oxadiazol-3-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 144795173
N-cyclohexyl-3-[6-(pyrrolidin-3-ylamino)-2-pyridinyl]imidazo[1,2-b]pyridazin-6-amine;ethane
CID 164537186
N,6-diphenylimidazo[1,2-b]pyridazine-3-carboxamide
CID 66940922
N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]-4-methylsulfonylbenzamide
CID 123196688
6-(cyclohexylamino)-8-(cyclopropylamino)-N-pyridin-4-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 59624903
8-anilino-6-(cyclohexylamino)-N-pyridin-3-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 143846754
N-(3-chlorophenyl)-6-(cyclohexylamino)-2-methylpyrimidine-4-carboxamide
CID 109363869
2-bromo-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]-4-methylsulfonylbenzamide
CID 123457501
N-(3-acetamidophenyl)-6-(cyclopentylamino)-2-methylpyrimidine-4-carboxamide
CID 109363196

Frequently Asked Questions

What is the IUPAC name of 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide?
The IUPAC name of 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide (CID 144795157) is 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide.
What is the SMILES notation for 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide?
The canonical SMILES for 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide is Cc1nc(-c2cccc(NC(=O)c3cnc4ccc(NC5CCCCC5)nn34)c2)co1.
What is the InChIKey of 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide?
The InChIKey is NMWVLFJIQACFGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O2/c1-15-25-19(14-31-15)16-6-5-9-18(12-16)27-23(30)20-13-24-22-11-10-21(28-29(20)22)26-17-7-3-2-4-8-17/h5-6,9-14,17H,2-4,7-8H2,1H3,(H,26,28)(H,27,30).
What are the key properties of 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide?
6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide has a molecular weight of 416.49 g/mol, XLogP of 4.69, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide is sourced from PubChem (CID 144795157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).