N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine

C16H26N4 — CID 104731511

IUPACN-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCCC(CC)C(C)Nc1nccn2nc(C(C)C)cc12
InChIInChI=1S/C16H26N4/c1-6-13(7-2)12(5)18-16-15-10-14(11(3)4)19-20(15)9-8-17-16/h8-13H,6-7H2,1-5H3,(H,17,18)
InChIKeyXSLKIEGSLJSWNN-UHFFFAOYSA-N
MW274.41 g/mol
LogP4.09
Rot. Bonds6

About N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine

N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 104731511) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
PubChem CID104731511
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC NameN-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCCC(CC)C(C)Nc1nccn2nc(C(C)C)cc12
InChIInChI=1S/C16H26N4/c1-6-13(7-2)12(5)18-16-15-10-14(11(3)4)19-20(15)9-8-17-16/h8-13H,6-7H2,1-5H3,(H,17,18)
InChIKeyXSLKIEGSLJSWNN-UHFFFAOYSA-N
XLogP4.09
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-pent-1-yn-3-yl-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 114161412
(2S)-3-methyl-2-[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]butan-1-ol
CID 114983251
2-N-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,2-diamine
CID 104732624
N-ethyl-N-methyl-2-[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]propanamide
CID 103111606
N-(4-methoxybutan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731643
N-octyl-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104731980
4,4-dimethyl-3-N-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)pentane-1,3-diamine
CID 106357724
4-[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]pentanoic acid
CID 104729549
2-methyl-3-[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]propanoic acid
CID 113446134
N-(2-ethoxyethyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 104730730
methyl 3-hydroxy-2-[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]propanoate
CID 104733378
2-[[(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]butanoic acid
CID 104729603

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine (CID 104731511) is N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine is CCC(CC)C(C)Nc1nccn2nc(C(C)C)cc12.
What is the InChIKey of N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is XSLKIEGSLJSWNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-6-13(7-2)12(5)18-16-15-10-14(11(3)4)19-20(15)9-8-17-16/h8-13H,6-7H2,1-5H3,(H,17,18).
What are the key properties of N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine?
N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 274.41 g/mol, XLogP of 4.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylpentan-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 104731511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).