(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone

C18H25N5O2 — CID 87050991

IUPAC(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone
SMILESCOc1ccc2nc(C(=O)N3CCC(N4CCCCC4)CC3)cn2n1
InChIInChI=1S/C18H25N5O2/c1-25-17-6-5-16-19-15(13-23(16)20-17)18(24)22-11-7-14(8-12-22)21-9-3-2-4-10-21/h5-6,13-14H,2-4,7-12H2,1H3
InChIKeyHRUCSHJHFKGDEL-UHFFFAOYSA-N
MW343.43 g/mol
LogP1.83
Rot. Bonds3

About (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone

(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone (PubChem CID 87050991) has the molecular formula C18H25N5O2 and a molecular weight of 343.43 g/mol. Its IUPAC name is (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone
PubChem CID87050991
Molecular FormulaC18H25N5O2
Molecular Weight343.43 g/mol
Exact Mass343.20
IUPAC Name(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone
SMILESCOc1ccc2nc(C(=O)N3CCC(N4CCCCC4)CC3)cn2n1
InChIInChI=1S/C18H25N5O2/c1-25-17-6-5-16-19-15(13-23(16)20-17)18(24)22-11-7-14(8-12-22)21-9-3-2-4-10-21/h5-6,13-14H,2-4,7-12H2,1H3
InChIKeyHRUCSHJHFKGDEL-UHFFFAOYSA-N
XLogP1.83
TPSA62.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[4-(2,5-dimethylphenyl)piperazin-1-yl]-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)methanone
CID 53166436
(6-methoxy-2-methylimidazo[1,2-b]pyridazin-3-yl)-piperidin-1-ylmethanone
CID 166184740
[4-(4-piperidin-1-ylpiperidine-1-carbonyl)phenyl]-(4-piperidin-1-ylpiperidin-1-yl)methanone
CID 70679311
(6-fluoro-2-pyridinyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 115497554
(3-methoxyphenyl)-(4-piperidin-1-ylpiperidin-1-yl)methanone
CID 110868482
(6-ethoxyimidazo[1,2-b]pyridazin-2-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone
CID 53166458
(4-piperidin-1-ylpiperidin-1-yl)-(2H-triazol-4-yl)methanone
CID 78968357
(2-tert-butylimidazo[1,2-b]pyridazin-6-yl)-piperidin-1-ylmethanone
CID 154830696
(4-amino-2-pyridinyl)-(4-piperidin-1-ylpiperidin-1-yl)methanone
CID 62160832
ethane;(3-hydroxypyrrolidin-1-yl)-(6-propan-2-ylimidazo[1,2-b]pyridazin-2-yl)methanone
CID 171811262
6-methoxy-N-[(4-methylphenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide
CID 87051013
[1-(1-cycloheptylpiperidin-4-yl)triazol-4-yl]-piperidin-1-ylmethanone
CID 26318869

Frequently Asked Questions

What is the IUPAC name of (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone?
The IUPAC name of (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone (CID 87050991) is (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone.
What is the SMILES notation for (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone?
The canonical SMILES for (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone is COc1ccc2nc(C(=O)N3CCC(N4CCCCC4)CC3)cn2n1.
What is the InChIKey of (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone?
The InChIKey is HRUCSHJHFKGDEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O2/c1-25-17-6-5-16-19-15(13-23(16)20-17)18(24)22-11-7-14(8-12-22)21-9-3-2-4-10-21/h5-6,13-14H,2-4,7-12H2,1H3.
What are the key properties of (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone?
(6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone has a molecular weight of 343.43 g/mol, XLogP of 1.83, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxyimidazo[1,2-b]pyridazin-2-yl)-(4-piperidin-1-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 87050991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).