6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide

C18H21N7O — CID 146669270

IUPAC6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide
SMILESCN(C)c1ccc(C(=O)Nc2cnc3ccc(N4CCCC4)nn23)cn1
InChIInChI=1S/C18H21N7O/c1-23(2)14-6-5-13(11-19-14)18(26)21-17-12-20-15-7-8-16(22-25(15)17)24-9-3-4-10-24/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,26)
InChIKeyBMYYSPNKADSOLA-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.04
Rot. Bonds4

About 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide

6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide (PubChem CID 146669270) has the molecular formula C18H21N7O and a molecular weight of 351.41 g/mol. Its IUPAC name is 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide
PubChem CID146669270
Molecular FormulaC18H21N7O
Molecular Weight351.41 g/mol
Exact Mass351.18
IUPAC Name6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide
SMILESCN(C)c1ccc(C(=O)Nc2cnc3ccc(N4CCCC4)nn23)cn1
InChIInChI=1S/C18H21N7O/c1-23(2)14-6-5-13(11-19-14)18(26)21-17-12-20-15-7-8-16(22-25(15)17)24-9-3-4-10-24/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,26)
InChIKeyBMYYSPNKADSOLA-UHFFFAOYSA-N
XLogP2.04
TPSA78.66 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-methyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-amine
CID 146669273
6-(3-hydroxypyrrolidin-1-yl)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridazine-3-carboxamide
CID 146669783
N-methyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 146415960
N-cyclooctyl-6-(dimethylamino)pyridine-3-carboxamide
CID 39400603
N-cycloheptyl-6-(dimethylamino)pyridine-3-carboxamide
CID 39400820
6-(dimethylamino)-N-(1-pyridin-2-ylpiperidin-4-yl)pyridine-3-carboxamide
CID 86989964
6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide
CID 154735988
4-[[6-(dimethylamino)pyridine-3-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 60809997
2-[[6-(dimethylamino)pyridine-3-carbonyl]amino]pyridine-3-carboxylic acid
CID 63651994
[6-(dimethylamino)-3-pyridinyl]-(4-pyrazin-2-yl-1,4-diazepan-1-yl)methanone
CID 138378091
2-[3-[[6-(dimethylamino)pyridine-3-carbonyl]amino]pyrazol-1-yl]-2-methylpropanoic acid
CID 138033282
6-(azepan-1-yl)-N-[2-cyano-4-(dimethylamino)-5-methylphenyl]pyridine-3-carboxamide
CID 154736849

Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide?
The IUPAC name of 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide (CID 146669270) is 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide is CN(C)c1ccc(C(=O)Nc2cnc3ccc(N4CCCC4)nn23)cn1.
What is the InChIKey of 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide?
The InChIKey is BMYYSPNKADSOLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N7O/c1-23(2)14-6-5-13(11-19-14)18(26)21-17-12-20-15-7-8-16(22-25(15)17)24-9-3-4-10-24/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,26).
What are the key properties of 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide?
6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-N-(6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 146669270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).