5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide

C13H20N6O — CID 75438362

IUPAC5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide
SMILESCC(C)n1nccc1NC(=O)c1cnn(C(C)C)c1N
InChIInChI=1S/C13H20N6O/c1-8(2)18-11(5-6-15-18)17-13(20)10-7-16-19(9(3)4)12(10)14/h5-9H,14H2,1-4H3,(H,17,20)
InChIKeyVNWLYSLZLYLSDQ-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.08
Rot. Bonds4

About 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide

5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide (PubChem CID 75438362) has the molecular formula C13H20N6O and a molecular weight of 276.34 g/mol. Its IUPAC name is 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide
PubChem CID75438362
Molecular FormulaC13H20N6O
Molecular Weight276.34 g/mol
Exact Mass276.17
IUPAC Name5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide
SMILESCC(C)n1nccc1NC(=O)c1cnn(C(C)C)c1N
InChIInChI=1S/C13H20N6O/c1-8(2)18-11(5-6-15-18)17-13(20)10-7-16-19(9(3)4)12(10)14/h5-9H,14H2,1-4H3,(H,17,20)
InChIKeyVNWLYSLZLYLSDQ-UHFFFAOYSA-N
XLogP2.08
TPSA90.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-2-methyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-carboxamide
CID 54917197
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CID 107073845
2,4-dihydroxy-N-(2-propan-2-ylpyrazol-3-yl)benzamide
CID 103606134
4-amino-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-5-carboxamide
CID 63107053
2-chloro-5-methylsulfonyl-N-(2-propan-2-ylpyrazol-3-yl)benzamide
CID 78772248
4-amino-5-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-3-carboxamide
CID 62077396
1-(5-amino-1-propan-2-ylpyrazol-4-yl)ethanone
CID 119054332
5-amino-N-cyclopropyl-1-propan-2-ylpyrazole-4-carboxamide
CID 117213743
4-(methylsulfamoyl)-N-(2-propan-2-ylpyrazol-3-yl)benzamide
CID 30186458
4-fluoro-2-methyl-N-(2-propan-2-ylpyrazol-3-yl)benzamide
CID 112702320
2-fluoro-4-methyl-N-(2-propan-2-ylpyrazol-3-yl)benzamide
CID 79777050
4-tert-butyl-N-(2-propan-2-ylpyrazol-3-yl)benzamide
CID 30182601

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide?
The IUPAC name of 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide (CID 75438362) is 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide is CC(C)n1nccc1NC(=O)c1cnn(C(C)C)c1N.
What is the InChIKey of 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide?
The InChIKey is VNWLYSLZLYLSDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6O/c1-8(2)18-11(5-6-15-18)17-13(20)10-7-16-19(9(3)4)12(10)14/h5-9H,14H2,1-4H3,(H,17,20).
What are the key properties of 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide?
5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 75438362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).