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

C14H23N5 — CID 104732617

IUPAC2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine
SMILESCCC(CN)Nc1nccn2nc(C(C)(C)C)cc12
InChIInChI=1S/C14H23N5/c1-5-10(9-15)17-13-11-8-12(14(2,3)4)18-19(11)7-6-16-13/h6-8,10H,5,9,15H2,1-4H3,(H,16,17)
InChIKeyYBVAUWXYBAHJAT-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.18
Rot. Bonds4

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

2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine (PubChem CID 104732617) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine.

Molecular Properties

Compound Name2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine
PubChem CID104732617
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC Name2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine
SMILESCCC(CN)Nc1nccn2nc(C(C)(C)C)cc12
InChIInChI=1S/C14H23N5/c1-5-10(9-15)17-13-11-8-12(14(2,3)4)18-19(11)7-6-16-13/h6-8,10H,5,9,15H2,1-4H3,(H,16,17)
InChIKeyYBVAUWXYBAHJAT-UHFFFAOYSA-N
XLogP2.18
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]propane-1,3-diol
CID 104731728
2-tert-butyl-N-pent-1-yn-3-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 106231271
2-N-pyrazolo[1,5-a]pyrazin-4-ylbutane-1,2-diamine
CID 104732618
2-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,2-diamine
CID 104732620
2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine
CID 106329795
2-tert-butyl-N-(2-methylpropyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730378
N-but-3-en-2-yl-2-tert-butylpyrazolo[1,5-a]pyrazin-4-amine
CID 113480150
2-N-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,2-diamine
CID 104732624
2-tert-butyl-N-(2,2-difluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 113446406
N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine
CID 107323432
2-tert-butyl-N-(2-chloroethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104733907
2-methyl-N'-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-yl]propane-1,3-diamine
CID 104734259

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine?
The IUPAC name of 2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine (CID 104732617) is 2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine.
What is the SMILES notation for 2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine?
The canonical SMILES for 2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine is CCC(CN)Nc1nccn2nc(C(C)(C)C)cc12.
What is the InChIKey of 2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine?
The InChIKey is YBVAUWXYBAHJAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-5-10(9-15)17-13-11-8-12(14(2,3)4)18-19(11)7-6-16-13/h6-8,10H,5,9,15H2,1-4H3,(H,16,17).
What are the key properties of 2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine?
2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine has a molecular weight of 261.37 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine is sourced from PubChem (CID 104732617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).