1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol

C11H21N3O — CID 64821238

IUPAC1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol
SMILESCCc1c(C)nn(CC(C)(O)CN)c1C
InChIInChI=1S/C11H21N3O/c1-5-10-8(2)13-14(9(10)3)7-11(4,15)6-12/h15H,5-7,12H2,1-4H3
InChIKeyUMRJSKDLJRBBAF-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.77
Rot. Bonds4

About 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol

1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol (PubChem CID 64821238) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol
PubChem CID64821238
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol
SMILESCCc1c(C)nn(CC(C)(O)CN)c1C
InChIInChI=1S/C11H21N3O/c1-5-10-8(2)13-14(9(10)3)7-11(4,15)6-12/h15H,5-7,12H2,1-4H3
InChIKeyUMRJSKDLJRBBAF-UHFFFAOYSA-N
XLogP0.77
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-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

1-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylbutan-2-ol
CID 114495869
1-amino-6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylhexan-2-ol
CID 64821440
2-amino-2-cyclopropyl-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)propanamide
CID 63919904
ethyl 2-(4-ethyl-3,5-dimethylpyrazol-1-yl)acetate
CID 50888392
2-amino-4-(4-ethyl-3,5-dimethylpyrazol-1-yl)butan-1-ol
CID 64811343
methyl 2-amino-2-cyclopropyl-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)propanoate
CID 63919117
5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methyl-2-(methylamino)pentan-1-ol
CID 64810713
2-amino-2-ethyl-5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pentan-1-ol
CID 106810069
3-[4-(ethylaminomethyl)-3,5-dimethylpyrazol-1-yl]-2,2-dimethylpropanoic acid
CID 79620308
2,2-dimethyl-3-(3,4,5-trimethylpyrazol-1-yl)propan-1-amine
CID 79621605
1-(4-iodo-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol
CID 164946156
5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pentan-1-ol
CID 62229176

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol?
The IUPAC name of 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol (CID 64821238) is 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol.
What is the SMILES notation for 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol?
The canonical SMILES for 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol is CCc1c(C)nn(CC(C)(O)CN)c1C.
What is the InChIKey of 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol?
The InChIKey is UMRJSKDLJRBBAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-5-10-8(2)13-14(9(10)3)7-11(4,15)6-12/h15H,5-7,12H2,1-4H3.
What are the key properties of 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol?
1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol has a molecular weight of 211.31 g/mol, XLogP of 0.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-methylpropan-2-ol is sourced from PubChem (CID 64821238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).