2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide

C15H23N5O — CID 104731043

IUPAC2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide
SMILESCC(Nc1nccn2nc(C(C)(C)C)cc12)C(=O)N(C)C
InChIInChI=1S/C15H23N5O/c1-10(14(21)19(5)6)17-13-11-9-12(15(2,3)4)18-20(11)8-7-16-13/h7-10H,1-6H3,(H,16,17)
InChIKeySXDWRQVMYPJSKG-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.92
Rot. Bonds3

About 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide

2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide (PubChem CID 104731043) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide
PubChem CID104731043
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide
SMILESCC(Nc1nccn2nc(C(C)(C)C)cc12)C(=O)N(C)C
InChIInChI=1S/C15H23N5O/c1-10(14(21)19(5)6)17-13-11-9-12(15(2,3)4)18-20(11)8-7-16-13/h7-10H,1-6H3,(H,16,17)
InChIKeySXDWRQVMYPJSKG-UHFFFAOYSA-N
XLogP1.92
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide (CID 104731043) is 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide is CC(Nc1nccn2nc(C(C)(C)C)cc12)C(=O)N(C)C.
What is the InChIKey of 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide?
The InChIKey is SXDWRQVMYPJSKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-10(14(21)19(5)6)17-13-11-9-12(15(2,3)4)18-20(11)8-7-16-13/h7-10H,1-6H3,(H,16,17).
What are the key properties of 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide?
2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide has a molecular weight of 289.38 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 104731043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).