(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine

C12H17N5 — CID 104729923

IUPAC(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine
SMILESNCC1CCCN(c2nccn3nccc23)C1
InChIInChI=1S/C12H17N5/c13-8-10-2-1-6-16(9-10)12-11-3-4-15-17(11)7-5-14-12/h3-5,7,10H,1-2,6,8-9,13H2
InChIKeyCHTQGTBFWCTKPC-UHFFFAOYSA-N
MW231.30 g/mol
LogP0.90
Rot. Bonds2

About (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine

(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine (PubChem CID 104729923) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine.

Molecular Properties

Compound Name(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine
PubChem CID104729923
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine
SMILESNCC1CCCN(c2nccn3nccc23)C1
InChIInChI=1S/C12H17N5/c13-8-10-2-1-6-16(9-10)12-11-3-4-15-17(11)7-5-14-12/h3-5,7,10H,1-2,6,8-9,13H2
InChIKeyCHTQGTBFWCTKPC-UHFFFAOYSA-N
XLogP0.90
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-amine
CID 91811933
4-[3-(bromomethyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrazine
CID 104734120
1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-3-carboxamide
CID 172899821
1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)ethanone
CID 113446199
[1-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]piperidin-3-yl]methanamine
CID 163302026
4-(4-pyrazolo[1,5-a]pyrazin-4-ylpiperazin-1-yl)butan-1-amine
CID 104729861
4-[4-(2-chloroethyl)-1,4-diazepan-1-yl]pyrazolo[1,5-a]pyrazine
CID 113446615
2-(chloromethyl)-4-pyrazolo[1,5-a]pyrazin-4-ylmorpholine
CID 104734139
[1-(1-methylimidazol-2-yl)piperidin-3-yl]methanamine
CID 62132389
4-[4-(3-bromo-2-pyridinyl)piperazin-1-yl]pyrazolo[1,5-a]pyrazine
CID 166605461
4-methyl-1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidin-3-amine
CID 103577532
4-[4-(2-chloroethyl)piperazin-1-yl]pyrazolo[1,5-a]pyrazine
CID 113446610

Frequently Asked Questions

What is the IUPAC name of (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine?
The IUPAC name of (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine (CID 104729923) is (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine.
What is the SMILES notation for (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine?
The canonical SMILES for (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine is NCC1CCCN(c2nccn3nccc23)C1.
What is the InChIKey of (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine?
The InChIKey is CHTQGTBFWCTKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c13-8-10-2-1-6-16(9-10)12-11-3-4-15-17(11)7-5-14-12/h3-5,7,10H,1-2,6,8-9,13H2.
What are the key properties of (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine?
(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine has a molecular weight of 231.30 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)methanamine is sourced from PubChem (CID 104729923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).