1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol

C11H21N3O — CID 79389441

IUPAC1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol
SMILESCc1cc(CN(C)CC(C)(C)O)n(C)n1
InChIInChI=1S/C11H21N3O/c1-9-6-10(14(5)12-9)7-13(4)8-11(2,3)15/h6,15H,7-8H2,1-5H3
InChIKeyKKBIBDLZARLNNH-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.93
Rot. Bonds4

About 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol

1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol (PubChem CID 79389441) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol
PubChem CID79389441
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol
SMILESCc1cc(CN(C)CC(C)(C)O)n(C)n1
InChIInChI=1S/C11H21N3O/c1-9-6-10(14(5)12-9)7-13(4)8-11(2,3)15/h6,15H,7-8H2,1-5H3
InChIKeyKKBIBDLZARLNNH-UHFFFAOYSA-N
XLogP0.93
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-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

5-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]pentan-1-ol
CID 107203759
1-N-[(2,5-dimethylpyrazol-3-yl)methyl]-1-N,4-dimethylpentane-1,3-diamine
CID 113285556
N-[[3-[amino(dihydroxy)-λ4-sulfanyl]-1-methylpyrazol-5-yl]methyl]-2,2,2-trifluoro-N-methylethanamine
CID 142529351
1-[ethyl-[(3-ethyl-1-methylpyrazol-5-yl)methyl]amino]-2-methylpropan-2-ol
CID 79389742
2-methyl-1-[methyl-[(4-methyl-1,2,4-triazol-3-yl)methyl]amino]propan-2-ol
CID 78964774
5-(chloromethyl)-1,3-dimethylpyrazole
CID 4961270
1-(2,5-dimethylpyrazol-3-yl)-4-methoxy-4-methylpentan-2-ol
CID 103027581
2-[(2,5-dimethylpyrazol-3-yl)methyl]-2-methylbutan-1-ol
CID 66058323
1-(dimethylamino)-3-(2,5-dimethylpyrazol-3-yl)propan-2-one
CID 79078418
4-(tert-butylamino)-1-(2,5-dimethylpyrazol-3-yl)-2-methylbutan-2-ol
CID 66002859
1-[(2,5-dimethylpyrazol-3-yl)methylamino]-2-methylpentan-2-ol
CID 106293010
2-[2,2-difluoroethyl-[(2,5-dimethylpyrazol-3-yl)methyl]amino]ethanol
CID 107485053

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol?
The IUPAC name of 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol (CID 79389441) is 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol is Cc1cc(CN(C)CC(C)(C)O)n(C)n1.
What is the InChIKey of 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol?
The InChIKey is KKBIBDLZARLNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-9-6-10(14(5)12-9)7-13(4)8-11(2,3)15/h6,15H,7-8H2,1-5H3.
What are the key properties of 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol?
1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol has a molecular weight of 211.31 g/mol, XLogP of 0.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-dimethylpyrazol-3-yl)methyl-methylamino]-2-methylpropan-2-ol is sourced from PubChem (CID 79389441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).