4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol

C10H14N4O — CID 175786677

IUPAC4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol
SMILESOCCCCNc1ccc2nccn2n1
InChIInChI=1S/C10H14N4O/c15-8-2-1-5-11-9-3-4-10-12-6-7-14(10)13-9/h3-4,6-7,15H,1-2,5,8H2,(H,11,13)
InChIKeySQFXHPWOUBLSDH-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.91
Rot. Bonds5

About 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol

4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol (PubChem CID 175786677) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol.

Molecular Properties

Compound Name4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol
PubChem CID175786677
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol
SMILESOCCCCNc1ccc2nccn2n1
InChIInChI=1S/C10H14N4O/c15-8-2-1-5-11-9-3-4-10-12-6-7-14(10)13-9/h3-4,6-7,15H,1-2,5,8H2,(H,11,13)
InChIKeySQFXHPWOUBLSDH-UHFFFAOYSA-N
XLogP0.91
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol?
The IUPAC name of 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol (CID 175786677) is 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol.
What is the SMILES notation for 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol?
The canonical SMILES for 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol is OCCCCNc1ccc2nccn2n1.
What is the InChIKey of 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol?
The InChIKey is SQFXHPWOUBLSDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c15-8-2-1-5-11-9-3-4-10-12-6-7-14(10)13-9/h3-4,6-7,15H,1-2,5,8H2,(H,11,13).
What are the key properties of 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol?
4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol has a molecular weight of 206.25 g/mol, XLogP of 0.91, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(imidazo[1,2-b]pyridazin-6-ylamino)butan-1-ol is sourced from PubChem (CID 175786677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).