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

C15H25N5 — CID 107323432

IUPACN'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine
SMILESCC(C)(C)c1cc2c(NCCCCCN)nccn2n1
InChIInChI=1S/C15H25N5/c1-15(2,3)13-11-12-14(17-8-6-4-5-7-16)18-9-10-20(12)19-13/h9-11H,4-8,16H2,1-3H3,(H,17,18)
InChIKeyAWCIWCJRFRNMKD-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.57
Rot. Bonds6

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

N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine (PubChem CID 107323432) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine.

Molecular Properties

Compound NameN'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine
PubChem CID107323432
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine
SMILESCC(C)(C)c1cc2c(NCCCCCN)nccn2n1
InChIInChI=1S/C15H25N5/c1-15(2,3)13-11-12-14(17-8-6-4-5-7-16)18-9-10-20(12)19-13/h9-11H,4-8,16H2,1-3H3,(H,17,18)
InChIKeyAWCIWCJRFRNMKD-UHFFFAOYSA-N
XLogP2.57
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-tert-butyl-N-(4,4,4-trifluorobutyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731973
N'-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,4-diamine
CID 104730160
2-tert-butyl-N-(2-chloroethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104733907
N',N'-dimethyl-N-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-yl]butane-1,4-diamine
CID 104731247
2-tert-butyl-N-pent-3-ynylpyrazolo[1,5-a]pyrazin-4-amine
CID 116644524
N-(5-methylhexyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731951
N-(4-methoxybutyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731181
2-tert-butyl-N-(2-methylpropyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730378
2-tert-butyl-N-[2-(2-chloroethoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-amine
CID 104733925
N-(3-methylsulfanylpropyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731532
2-tert-butyl-N-(2,2-difluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 113446406
2-[2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]ethoxy]acetamide
CID 106239775

Frequently Asked Questions

What is the IUPAC name of N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine?
The IUPAC name of N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine (CID 107323432) is N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine.
What is the SMILES notation for N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine?
The canonical SMILES for N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine is CC(C)(C)c1cc2c(NCCCCCN)nccn2n1.
What is the InChIKey of N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine?
The InChIKey is AWCIWCJRFRNMKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-15(2,3)13-11-12-14(17-8-6-4-5-7-16)18-9-10-20(12)19-13/h9-11H,4-8,16H2,1-3H3,(H,17,18).
What are the key properties of N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine?
N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine has a molecular weight of 275.40 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine is sourced from PubChem (CID 107323432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).