2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide

C17H17N5O — CID 69380502

IUPAC2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide
SMILESNC(=O)c1c(-c2ccccc2)nc2ccc(N3CCCC3)nn12
InChIInChI=1S/C17H17N5O/c18-17(23)16-15(12-6-2-1-3-7-12)19-13-8-9-14(20-22(13)16)21-10-4-5-11-21/h1-3,6-9H,4-5,10-11H2,(H2,18,23)
InChIKeyZHSOGEVKELIYFB-UHFFFAOYSA-N
MW307.36 g/mol
LogP2.10
Rot. Bonds3

About 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide

2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide (PubChem CID 69380502) has the molecular formula C17H17N5O and a molecular weight of 307.36 g/mol. Its IUPAC name is 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide.

Molecular Properties

Compound Name2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide
PubChem CID69380502
Molecular FormulaC17H17N5O
Molecular Weight307.36 g/mol
Exact Mass307.14
IUPAC Name2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide
SMILESNC(=O)c1c(-c2ccccc2)nc2ccc(N3CCCC3)nn12
InChIInChI=1S/C17H17N5O/c18-17(23)16-15(12-6-2-1-3-7-12)19-13-8-9-14(20-22(13)16)21-10-4-5-11-21/h1-3,6-9H,4-5,10-11H2,(H2,18,23)
InChIKeyZHSOGEVKELIYFB-UHFFFAOYSA-N
XLogP2.10
TPSA76.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazine-3-carboxylic acid
CID 156641443
N-[(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)methyl]acetamide
CID 24753418
6-phenyl-2-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 175331833
cyclopentyl-[4-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1,4-diazepan-1-yl]methanone
CID 134802545
[1-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
CID 47060299
1-[6-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-2-phenylimidazo[1,2-b]pyridazin-3-yl]ethanone
CID 167622599
6-(azepan-1-yl)pyridine-2-carboxamide
CID 173077887
N-tert-butyl-6-morpholin-4-yl-2-phenylimidazo[1,2-b]pyridazin-3-amine
CID 135018214
2-methoxy-1-[4-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1,4-diazepan-1-yl]ethanone
CID 134801591
(4-fluorophenyl)-[4-(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1,4-diazepan-1-yl]methanone
CID 134801603
(2-phenylimidazo[1,2-a]pyridin-3-yl)-pyrrolidin-1-ylmethanone
CID 155383445
3-methyl-2-phenyl-6-[4-(pyridin-4-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine
CID 57407086

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide?
The IUPAC name of 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide (CID 69380502) is 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide.
What is the SMILES notation for 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide?
The canonical SMILES for 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide is NC(=O)c1c(-c2ccccc2)nc2ccc(N3CCCC3)nn12.
What is the InChIKey of 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide?
The InChIKey is ZHSOGEVKELIYFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O/c18-17(23)16-15(12-6-2-1-3-7-12)19-13-8-9-14(20-22(13)16)21-10-4-5-11-21/h1-3,6-9H,4-5,10-11H2,(H2,18,23).
What are the key properties of 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide?
2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide has a molecular weight of 307.36 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-3-carboxamide is sourced from PubChem (CID 69380502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).