3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine

C12H18N4 — CID 103126804

IUPAC3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
SMILESCCC(C)CC(N)c1cnn2ccncc12
InChIInChI=1S/C12H18N4/c1-3-9(2)6-11(13)10-7-15-16-5-4-14-8-12(10)16/h4-5,7-9,11H,3,6,13H2,1-2H3
InChIKeyGCMTXGHESMSGPI-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.17
Rot. Bonds4

About 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine

3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine (PubChem CID 103126804) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine.

Molecular Properties

Compound Name3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
PubChem CID103126804
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
SMILESCCC(C)CC(N)c1cnn2ccncc12
InChIInChI=1S/C12H18N4/c1-3-9(2)6-11(13)10-7-15-16-5-4-14-8-12(10)16/h4-5,7-9,11H,3,6,13H2,1-2H3
InChIKeyGCMTXGHESMSGPI-UHFFFAOYSA-N
XLogP2.17
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dimethyl-1-pyrazolo[1,5-a]pyrazin-3-ylhexan-1-amine
CID 114201709
1-pyrazolo[1,5-a]pyrazin-3-ylpropan-1-amine
CID 103125780
2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103127963
2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103127579
N-ethyl-3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylbutan-1-amine
CID 103125922
2-(3,5-difluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103128392
N,2-diethyl-1-pyrazolo[1,5-a]pyrazin-3-ylbutan-1-amine
CID 103127786
1-pyrazolo[1,5-a]pyrazin-3-yl-2-pyridin-2-ylethanamine
CID 103127478
2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103127505
1-pyrazolo[1,5-a]pyrazin-3-yl-3-thiophen-2-ylpropan-1-amine
CID 103127230
N-ethyl-2-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
CID 114013583
1-pyrazolo[1,5-a]pyrazin-3-ylpent-3-ynylhydrazine
CID 103129490

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine?
The IUPAC name of 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine (CID 103126804) is 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine.
What is the SMILES notation for 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine?
The canonical SMILES for 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine is CCC(C)CC(N)c1cnn2ccncc12.
What is the InChIKey of 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine?
The InChIKey is GCMTXGHESMSGPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-3-9(2)6-11(13)10-7-15-16-5-4-14-8-12(10)16/h4-5,7-9,11H,3,6,13H2,1-2H3.
What are the key properties of 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine?
3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine has a molecular weight of 218.30 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine is sourced from PubChem (CID 103126804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).