2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol

C19H23FN6O2 — CID 174290597

IUPAC2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol
SMILESCOc1cc2ncc(-c3cccc(N[C@H]4CNCC4F)n3)n2nc1C(C)(C)O
InChIInChI=1S/C19H23FN6O2/c1-19(2,27)18-15(28-3)7-17-22-10-14(26(17)25-18)12-5-4-6-16(23-12)24-13-9-21-8-11(13)20/h4-7,10-11,13,21,27H,8-9H2,1-3H3,(H,23,24)/t11?,13-/m0/s1
InChIKeyPSEHPCIPCSYSCN-YUZLPWPTSA-N
MW386.43 g/mol
LogP1.75
Rot. Bonds5

About 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol

2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol (PubChem CID 174290597) has the molecular formula C19H23FN6O2 and a molecular weight of 386.43 g/mol. Its IUPAC name is 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol.

Molecular Properties

Compound Name2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol
PubChem CID174290597
Molecular FormulaC19H23FN6O2
Molecular Weight386.43 g/mol
Exact Mass386.19
IUPAC Name2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol
SMILESCOc1cc2ncc(-c3cccc(N[C@H]4CNCC4F)n3)n2nc1C(C)(C)O
InChIInChI=1S/C19H23FN6O2/c1-19(2,27)18-15(28-3)7-17-22-10-14(26(17)25-18)12-5-4-6-16(23-12)24-13-9-21-8-11(13)20/h4-7,10-11,13,21,27H,8-9H2,1-3H3,(H,23,24)/t11?,13-/m0/s1
InChIKeyPSEHPCIPCSYSCN-YUZLPWPTSA-N
XLogP1.75
TPSA96.60 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 51.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol 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-[4-[3-[6-[[(3S,4S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-a]pyridin-6-yl]pyrazol-1-yl]-2-methylpropan-2-ol
CID 166961707
2-[3-(6-bromo-2-pyridinyl)-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol
CID 164537214
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-4-methylpyridin-2-amine
CID 170630919
3-[6-[[(3S,4S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-N,N-dimethylimidazo[1,2-b]pyridazin-6-amine
CID 167122374
(2R)-1,1,1-trifluoro-2-[3-[6-[[(3S,4S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyrazin-6-yl]propan-2-ol
CID 167137335
2-[3-[3,5-difluoro-6-[(4-fluoropyrrolidin-3-yl)amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]-1,1,1-trifluoropropan-2-ol
CID 170631006
1-[3-[6-[(4-fluoropyrrolidin-3-yl)amino]-2-pyridinyl]-7-methoxyimidazo[1,2-a]pyridin-6-yl]pyrrolidin-2-one
CID 169129615
2-[3-[6-[(5-fluoropiperidin-3-yl)amino]-2-pyridinyl]-7-methoxyimidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 169129789
2-[3-[6-[[(5S)-5-fluoropiperidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 166961630
2-[3-[3-fluoro-6-[[(3R,4R)-4-fluoropyrrolidin-3-yl]methylamino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol
CID 170631092
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-N-(4-fluoropyrrolidin-3-yl)-5-methoxypyridin-2-amine
CID 170631062
5-fluoro-2-[[(3R,4R)-4-fluoropiperidin-3-yl]amino]-6-[6-(2-hydroxypropan-2-yl)-7-methoxyimidazo[1,2-b]pyridazin-3-yl]pyridine-3-carbonitrile
CID 177159618

Frequently Asked Questions

What is the IUPAC name of 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol?
The IUPAC name of 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol (CID 174290597) is 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol.
What is the SMILES notation for 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol?
The canonical SMILES for 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol is COc1cc2ncc(-c3cccc(N[C@H]4CNCC4F)n3)n2nc1C(C)(C)O.
What is the InChIKey of 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol?
The InChIKey is PSEHPCIPCSYSCN-YUZLPWPTSA-N. The full InChI is InChI=1S/C19H23FN6O2/c1-19(2,27)18-15(28-3)7-17-22-10-14(26(17)25-18)12-5-4-6-16(23-12)24-13-9-21-8-11(13)20/h4-7,10-11,13,21,27H,8-9H2,1-3H3,(H,23,24)/t11?,13-/m0/s1.
What are the key properties of 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol?
2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol has a molecular weight of 386.43 g/mol, XLogP of 1.75, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[6-[[(3S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]-7-methoxyimidazo[1,2-b]pyridazin-6-yl]propan-2-ol is sourced from PubChem (CID 174290597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).