2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol

C11H18N2O2 — CID 143616870

IUPAC2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol
SMILESCCC(C)(O)c1ccc(C(C)(C)O)nn1
InChIInChI=1S/C11H18N2O2/c1-5-11(4,15)9-7-6-8(12-13-9)10(2,3)14/h6-7,14-15H,5H2,1-4H3
InChIKeyFQJFHQMVQFOLHW-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.32
Rot. Bonds3

About 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol

2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol (PubChem CID 143616870) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol.

Molecular Properties

Compound Name2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol
PubChem CID143616870
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol
SMILESCCC(C)(O)c1ccc(C(C)(C)O)nn1
InChIInChI=1S/C11H18N2O2/c1-5-11(4,15)9-7-6-8(12-13-9)10(2,3)14/h6-7,14-15H,5H2,1-4H3
InChIKeyFQJFHQMVQFOLHW-UHFFFAOYSA-N
XLogP1.32
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-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

2-(5-fluoro-2-pyridinyl)butan-2-ol
CID 83124844
2-imidazol-1-id-4-ylbutan-2-ol;rubidium(1+)
CID 59168923
2-[2-(2-hydroxybutan-2-yl)phenyl]butan-2-ol
CID 18356493
2-(1-propan-2-yltriazol-4-yl)butan-2-ol
CID 130560981
2-[3,5-bis(2-hydroxypropan-2-yl)phenyl]butan-2-ol
CID 59095341
2-[3-(2-hydroxybutan-2-yl)-5-(2-hydroxypropan-2-yl)phenyl]butan-2-ol
CID 59095277
(2S)-2-[4-(trifluoromethyl)phenyl]butan-2-ol
CID 138977962
(2R)-2-(4-bromophenyl)butan-2-ol
CID 15642444
2-[1-(3,4-difluorophenyl)triazol-4-yl]butan-2-ol
CID 135135935
(2S)-2-(3,4-dichlorophenyl)butan-2-ol
CID 94471655
1-[4-(2-hydroxypropan-2-yl)triazol-1-yl]-2-methylbutan-2-ol
CID 114496925
2-(5,6-dimethyl-2-pyridinyl)propan-2-ol
CID 58229800

Frequently Asked Questions

What is the IUPAC name of 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol?
The IUPAC name of 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol (CID 143616870) is 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol.
What is the SMILES notation for 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol?
The canonical SMILES for 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol is CCC(C)(O)c1ccc(C(C)(C)O)nn1.
What is the InChIKey of 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol?
The InChIKey is FQJFHQMVQFOLHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-5-11(4,15)9-7-6-8(12-13-9)10(2,3)14/h6-7,14-15H,5H2,1-4H3.
What are the key properties of 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol?
2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol has a molecular weight of 210.28 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]butan-2-ol is sourced from PubChem (CID 143616870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).