6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine

C25H30N8O — CID 143846846

IUPAC6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine
SMILESCc1cc(NC(=O)c2cnc3c(Nc4ccccc4)cc(N)nn23)ccn1.NC1CCCCC1
InChIInChI=1S/C19H17N7O.C6H13N/c1-12-9-14(7-8-21-12)24-19(27)16-11-22-18-15(10-17(20)25-26(16)18)23-13-5-3-2-4-6-13;7-6-4-2-1-3-5-6/h2-11,23H,1H3,(H2,20,25)(H,21,24,27);6H,1-5,7H2
InChIKeyHLCUYZXVNMMECW-UHFFFAOYSA-N
MW458.57 g/mol
LogP4.29
Rot. Bonds4

About 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine

6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine (PubChem CID 143846846) has the molecular formula C25H30N8O and a molecular weight of 458.57 g/mol. Its IUPAC name is 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine.

Molecular Properties

Compound Name6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine
PubChem CID143846846
Molecular FormulaC25H30N8O
Molecular Weight458.57 g/mol
Exact Mass458.25
IUPAC Name6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine
SMILESCc1cc(NC(=O)c2cnc3c(Nc4ccccc4)cc(N)nn23)ccn1.NC1CCCCC1
InChIInChI=1S/C19H17N7O.C6H13N/c1-12-9-14(7-8-21-12)24-19(27)16-11-22-18-15(10-17(20)25-26(16)18)23-13-5-3-2-4-6-13;7-6-4-2-1-3-5-6/h2-11,23H,1H3,(H2,20,25)(H,21,24,27);6H,1-5,7H2
InChIKeyHLCUYZXVNMMECW-UHFFFAOYSA-N
XLogP4.29
TPSA136.25 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.57
LogP ≤ 54.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_6_tetrazine(18)', 'substructure': 'N/A'}

Analyze 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-amino-8-anilino-N-[4-(dimethylamino)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 143846758
8-anilino-6-(cyclohexylamino)-N-pyridin-3-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 143846754
6-[(4-aminocyclohexyl)amino]-8-anilino-N-(4-fluorophenyl)imidazo[1,2-b]pyridazine-3-carboxamide
CID 59624739
6-amino-8-(benzylamino)-N-pyridin-4-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 143846848
8-anilino-6-(cyclohexylamino)-N-[3-(2-methyl-1,3-oxazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 144795147
6-(cyclohexylamino)-8-[4-(dimethylamino)anilino]-N-pyridin-4-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 143846794
6-[(2-aminocyclohexyl)amino]-8-anilino-N-(2-fluorophenyl)imidazo[1,2-b]pyridazine-3-carboxamide
CID 68762286
6-[(4-aminocyclohexyl)amino]-8-anilino-N-(2-fluoro-6-oxo-1H-pyridin-4-yl)imidazo[1,2-b]pyridazine-3-carboxamide
CID 59624716
6-[(4-aminocyclohexyl)amino]-8-[4-(4-methylpiperazin-1-yl)anilino]-N-pyridin-4-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 59624467
6-[(4-aminocyclohexyl)amino]-8-anilino-N-(6-morpholin-4-yl-3-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide
CID 59624479
6,8-bis[(4-aminocyclohexyl)amino]-N-pyridin-4-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 59624447
6-(cyclohexylamino)-8-(cyclopropylamino)-N-pyridin-4-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 59624903

Frequently Asked Questions

What is the IUPAC name of 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine?
The IUPAC name of 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine (CID 143846846) is 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine.
What is the SMILES notation for 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine?
The canonical SMILES for 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine is Cc1cc(NC(=O)c2cnc3c(Nc4ccccc4)cc(N)nn23)ccn1.NC1CCCCC1.
What is the InChIKey of 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine?
The InChIKey is HLCUYZXVNMMECW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N7O.C6H13N/c1-12-9-14(7-8-21-12)24-19(27)16-11-22-18-15(10-17(20)25-26(16)18)23-13-5-3-2-4-6-13;7-6-4-2-1-3-5-6/h2-11,23H,1H3,(H2,20,25)(H,21,24,27);6H,1-5,7H2.
What are the key properties of 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine?
6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine has a molecular weight of 458.57 g/mol, XLogP of 4.29, 4 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-8-anilino-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;cyclohexanamine is sourced from PubChem (CID 143846846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).