6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine

C26H27FN6 — CID 162486101

IUPAC6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine
SMILESFc1cccc([C@H]2CCCC2c2ccc3ncc(-c4cccc(N5CCNCC5)n4)n3n2)c1
InChIInChI=1S/C26H27FN6/c27-19-5-1-4-18(16-19)20-6-2-7-21(20)22-10-11-25-29-17-24(33(25)31-22)23-8-3-9-26(30-23)32-14-12-28-13-15-32/h1,3-5,8-11,16-17,20-21,28H,2,6-7,12-15H2/t20-,21?/m1/s1
InChIKeyHFURDBXBGUAIFM-VQCQRNETSA-N
MW442.54 g/mol
LogP4.39
Rot. Bonds4

About 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine

6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine (PubChem CID 162486101) has the molecular formula C26H27FN6 and a molecular weight of 442.54 g/mol. Its IUPAC name is 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine
PubChem CID162486101
Molecular FormulaC26H27FN6
Molecular Weight442.54 g/mol
Exact Mass442.23
IUPAC Name6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine
SMILESFc1cccc([C@H]2CCCC2c2ccc3ncc(-c4cccc(N5CCNCC5)n4)n3n2)c1
InChIInChI=1S/C26H27FN6/c27-19-5-1-4-18(16-19)20-6-2-7-21(20)22-10-11-25-29-17-24(33(25)31-22)23-8-3-9-26(30-23)32-14-12-28-13-15-32/h1,3-5,8-11,16-17,20-21,28H,2,6-7,12-15H2/t20-,21?/m1/s1
InChIKeyHFURDBXBGUAIFM-VQCQRNETSA-N
XLogP4.39
TPSA58.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.54
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine 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

1-[6-[6-[2-(3-fluorophenyl)piperidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperidin-4-ol
CID 58335467
1-[6-[6-[2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]pyrrolidine-3,4-diol
CID 76765226
N-cyclopropyl-1-[6-[6-[2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperidin-4-amine
CID 76765252
1-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]ethanone
CID 58335841
3-(3-fluorophenyl)-4-[3-(6-piperidin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazin-6-yl]morpholine
CID 67029481
[1-[6-[6-[2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperidin-4-yl] carbamate
CID 76765339
(2S,6R)-4-[6-[6-[2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine
CID 67029040
6-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]-2-oxa-6-azaspiro[3.3]heptane
CID 58335803
8-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]-3-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 58335744
6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]-3-(3-piperazin-1-ylphenyl)imidazo[1,2-b]pyridazine
CID 161331913
6-[2-(3-fluorophenyl)pyrrolidin-1-yl]-3-[6-(5-methyl-1H-imidazol-2-yl)-2-pyridinyl]imidazo[1,2-b]pyridazine
CID 58335886
(2S)-4-[6-[6-[2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]-2-methylmorpholine
CID 67029066

Frequently Asked Questions

What is the IUPAC name of 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine (CID 162486101) is 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine is Fc1cccc([C@H]2CCCC2c2ccc3ncc(-c4cccc(N5CCNCC5)n4)n3n2)c1.
What is the InChIKey of 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine?
The InChIKey is HFURDBXBGUAIFM-VQCQRNETSA-N. The full InChI is InChI=1S/C26H27FN6/c27-19-5-1-4-18(16-19)20-6-2-7-21(20)22-10-11-25-29-17-24(33(25)31-22)23-8-3-9-26(30-23)32-14-12-28-13-15-32/h1,3-5,8-11,16-17,20-21,28H,2,6-7,12-15H2/t20-,21?/m1/s1.
What are the key properties of 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine?
6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine has a molecular weight of 442.54 g/mol, XLogP of 4.39, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2S)-2-(3-fluorophenyl)cyclopentyl]-3-(6-piperazin-1-yl-2-pyridinyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 162486101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).