2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine

C16H26N4 — CID 106329795

IUPAC2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESCCC(C)(CC)Nc1nccn2nc(C(C)(C)C)cc12
InChIInChI=1S/C16H26N4/c1-7-16(6,8-2)18-14-12-11-13(15(3,4)5)19-20(12)10-9-17-14/h9-11H,7-8H2,1-6H3,(H,17,18)
InChIKeyOUJCPGRNQJCVOU-UHFFFAOYSA-N
MW274.41 g/mol
LogP4.02
Rot. Bonds4

About 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine

2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 106329795) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound Name2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID106329795
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC Name2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESCCC(C)(CC)Nc1nccn2nc(C(C)(C)C)cc12
InChIInChI=1S/C16H26N4/c1-7-16(6,8-2)18-14-12-11-13(15(3,4)5)19-20(12)10-9-17-14/h9-11H,7-8H2,1-6H3,(H,17,18)
InChIKeyOUJCPGRNQJCVOU-UHFFFAOYSA-N
XLogP4.02
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-tert-butyl-N-[3-(chloromethyl)pentan-3-yl]pyrazolo[1,5-a]pyrazin-4-amine
CID 104733983
3-methyl-3-N-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine
CID 106165731
2-tert-butyl-N-(2-chloroethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104733907
2-tert-butyl-N-(2-methylpropyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104730378
2-tert-butyl-N-(2,2-difluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 113446406
2-[(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)amino]propane-1,3-diol
CID 104731728
2-N-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)butane-1,2-diamine
CID 104732617
2-tert-butyl-N-pent-1-yn-3-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 106231271
N-(1,3-dichloro-2-methylpropan-2-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 104734163
2-tert-butyl-N-pent-3-ynylpyrazolo[1,5-a]pyrazin-4-amine
CID 116644524
N'-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,5-diamine
CID 107323432
2-tert-butyl-N-(3-chloro-2-methylpropyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104733993

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine (CID 106329795) is 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine is CCC(C)(CC)Nc1nccn2nc(C(C)(C)C)cc12.
What is the InChIKey of 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is OUJCPGRNQJCVOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-7-16(6,8-2)18-14-12-11-13(15(3,4)5)19-20(12)10-9-17-14/h9-11H,7-8H2,1-6H3,(H,17,18).
What are the key properties of 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine?
2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 274.41 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-N-(3-methylpentan-3-yl)pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 106329795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).