6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine

C19H21FN6O — CID 154575410

IUPAC6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine
SMILESFc1c(C2CC2)ncnc1N1CCC(COc2ccc3nccn3n2)CC1
InChIInChI=1S/C19H21FN6O/c20-17-18(14-1-2-14)22-12-23-19(17)25-8-5-13(6-9-25)11-27-16-4-3-15-21-7-10-26(15)24-16/h3-4,7,10,12-14H,1-2,5-6,8-9,11H2
InChIKeyHADJQDFBYXCFSS-UHFFFAOYSA-N
MW368.42 g/mol
LogP2.83
Rot. Bonds5

About 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine

6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine (PubChem CID 154575410) has the molecular formula C19H21FN6O and a molecular weight of 368.42 g/mol. Its IUPAC name is 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine
PubChem CID154575410
Molecular FormulaC19H21FN6O
Molecular Weight368.42 g/mol
Exact Mass368.18
IUPAC Name6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine
SMILESFc1c(C2CC2)ncnc1N1CCC(COc2ccc3nccn3n2)CC1
InChIInChI=1S/C19H21FN6O/c20-17-18(14-1-2-14)22-12-23-19(17)25-8-5-13(6-9-25)11-27-16-4-3-15-21-7-10-26(15)24-16/h3-4,7,10,12-14H,1-2,5-6,8-9,11H2
InChIKeyHADJQDFBYXCFSS-UHFFFAOYSA-N
XLogP2.83
TPSA68.44 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.42
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine?
The IUPAC name of 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine (CID 154575410) is 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine is Fc1c(C2CC2)ncnc1N1CCC(COc2ccc3nccn3n2)CC1.
What is the InChIKey of 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine?
The InChIKey is HADJQDFBYXCFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN6O/c20-17-18(14-1-2-14)22-12-23-19(17)25-8-5-13(6-9-25)11-27-16-4-3-15-21-7-10-26(15)24-16/h3-4,7,10,12-14H,1-2,5-6,8-9,11H2.
What are the key properties of 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine?
6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine has a molecular weight of 368.42 g/mol, XLogP of 2.83, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[1-(6-cyclopropyl-5-fluoropyrimidin-4-yl)piperidin-4-yl]methoxy]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 154575410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).