2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol

C15H21N5O — CID 123350253

IUPAC2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol
SMILESCCN(Cc1cnn(C2CCC2O)c1C)c1ccnnc1
InChIInChI=1S/C15H21N5O/c1-3-19(13-6-7-16-17-9-13)10-12-8-18-20(11(12)2)14-4-5-15(14)21/h6-9,14-15,21H,3-5,10H2,1-2H3
InChIKeyBHQKZHVFMLFVIW-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.70
Rot. Bonds5

About 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol

2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol (PubChem CID 123350253) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol.

Molecular Properties

Compound Name2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol
PubChem CID123350253
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol
SMILESCCN(Cc1cnn(C2CCC2O)c1C)c1ccnnc1
InChIInChI=1S/C15H21N5O/c1-3-19(13-6-7-16-17-9-13)10-12-8-18-20(11(12)2)14-4-5-15(14)21/h6-9,14-15,21H,3-5,10H2,1-2H3
InChIKeyBHQKZHVFMLFVIW-UHFFFAOYSA-N
XLogP1.70
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-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

(3R,4R)-4-methyl-1-pyridazin-4-ylpyrrolidin-3-ol
CID 54333694
N-ethyl-1-(2-hydroxycyclobutyl)-5-methyl-N-pyridazin-4-ylpyrazole-4-carboxamide
CID 118030337
(1,5-Dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol
CID 123583673
1-[(1-Propan-2-ylpyrazol-3-yl)methyl]piperidin-3-ol
CID 64294988
1-[(1-Pentan-3-ylpyrazol-3-yl)methyl]piperidin-3-ol
CID 64777683
1-[(1-Butan-2-ylpyrazol-3-yl)methyl]piperidin-3-ol
CID 64777685
1-[(1-Butan-2-ylpyrazol-3-yl)methyl]-4-methylpiperidin-3-ol
CID 102959680
4-Methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]piperidin-3-ol
CID 103898643
(3S)-1-[(1-butan-2-ylpyrazol-3-yl)methyl]piperidin-3-ol
CID 107225978
(3S)-1-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidin-3-ol
CID 107226041
(3S)-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]piperidin-3-ol
CID 107226186
2-[4-[(2-Methylpyrazol-3-yl)methyl]piperazin-1-yl]butan-1-ol
CID 109935755

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol?
The IUPAC name of 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol (CID 123350253) is 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol.
What is the SMILES notation for 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol?
The canonical SMILES for 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol is CCN(Cc1cnn(C2CCC2O)c1C)c1ccnnc1.
What is the InChIKey of 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol?
The InChIKey is BHQKZHVFMLFVIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-3-19(13-6-7-16-17-9-13)10-12-8-18-20(11(12)2)14-4-5-15(14)21/h6-9,14-15,21H,3-5,10H2,1-2H3.
What are the key properties of 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol?
2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol has a molecular weight of 287.37 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[ethyl(pyridazin-4-yl)amino]methyl]-5-methylpyrazol-1-yl]cyclobutan-1-ol is sourced from PubChem (CID 123350253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).