3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide

C11H20N4O — CID 82702680

IUPAC3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide
SMILESCCc1nn(CC(C)C(N)=O)c(CC)c1N
InChIInChI=1S/C11H20N4O/c1-4-8-10(12)9(5-2)15(14-8)6-7(3)11(13)16/h7H,4-6,12H2,1-3H3,(H2,13,16)
InChIKeyYFVLENHHGCJFPU-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.71
Rot. Bonds5

About 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide

3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide (PubChem CID 82702680) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide.

Molecular Properties

Compound Name3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide
PubChem CID82702680
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide
SMILESCCc1nn(CC(C)C(N)=O)c(CC)c1N
InChIInChI=1S/C11H20N4O/c1-4-8-10(12)9(5-2)15(14-8)6-7(3)11(13)16/h7H,4-6,12H2,1-3H3,(H2,13,16)
InChIKeyYFVLENHHGCJFPU-UHFFFAOYSA-N
XLogP0.71
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-diethyl-1-(2-methylpropyl)pyrazol-4-amine
CID 82703146
methyl 2-(4-amino-3,5-diethylpyrazol-1-yl)acetate
CID 82703075
2-(4-amino-3,5-diethylpyrazol-1-yl)-N-(3-methylbutyl)acetamide
CID 82702281
3,5-diethyl-1-(2-ethylsulfonylethyl)pyrazol-4-amine
CID 82702839
2-(4-amino-3,5-diethylpyrazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 82702213
ethyl 6-(4-amino-3,5-diethylpyrazol-1-yl)hexanoate
CID 82702685
2-(4-amino-3,5-diethylpyrazol-1-yl)-N-ethylpropanamide
CID 82702599
3-(3-amino-5-methylpyrazol-1-yl)-2-methylpropanamide
CID 130496612
1-benzyl-3,5-diethylpyrazol-4-amine
CID 82702837
3,5-diethyl-1-(3-ethylsulfonylpropyl)pyrazol-4-amine
CID 82702521
3,5-diethyl-1-[2-(2-methoxyethoxy)ethyl]pyrazol-4-amine
CID 82702606
3,5-diethyl-1-(propoxymethyl)pyrazol-4-amine
CID 165471948

Frequently Asked Questions

What is the IUPAC name of 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide?
The IUPAC name of 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide (CID 82702680) is 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide.
What is the SMILES notation for 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide?
The canonical SMILES for 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide is CCc1nn(CC(C)C(N)=O)c(CC)c1N.
What is the InChIKey of 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide?
The InChIKey is YFVLENHHGCJFPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-4-8-10(12)9(5-2)15(14-8)6-7(3)11(13)16/h7H,4-6,12H2,1-3H3,(H2,13,16).
What are the key properties of 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide?
3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide has a molecular weight of 224.31 g/mol, XLogP of 0.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-amino-3,5-diethylpyrazol-1-yl)-2-methylpropanamide is sourced from PubChem (CID 82702680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).