[1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine

C13H19N5 — CID 104734304

IUPAC[1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine
SMILESCC(C)c1cc2c(N3CC(CN)C3)nccn2n1
InChIInChI=1S/C13H19N5/c1-9(2)11-5-12-13(15-3-4-18(12)16-11)17-7-10(6-14)8-17/h3-5,9-10H,6-8,14H2,1-2H3
InChIKeyINJNNTCVFZDWHO-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.25
Rot. Bonds3

About [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine

[1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine (PubChem CID 104734304) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine
PubChem CID104734304
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC Name[1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine
SMILESCC(C)c1cc2c(N3CC(CN)C3)nccn2n1
InChIInChI=1S/C13H19N5/c1-9(2)11-5-12-13(15-3-4-18(12)16-11)17-7-10(6-14)8-17/h3-5,9-10H,6-8,14H2,1-2H3
InChIKeyINJNNTCVFZDWHO-UHFFFAOYSA-N
XLogP1.25
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[6-methyl-4-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)morpholin-2-yl]methanamine
CID 102938602
4-[3-(2-bromoethyl)piperidin-1-yl]-2-propan-2-ylpyrazolo[1,5-a]pyrazine
CID 104734126
1-[4-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)morpholin-2-yl]ethanamine
CID 104732835
1-[1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]ethanol
CID 106837325
4-(2-ethylimidazol-1-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrazine
CID 104734381
[1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)pyrrolidin-2-yl]methanol
CID 104733050
4-N-methyl-4-N-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)cyclohexane-1,4-diamine
CID 104729261
4-[2-(chloromethyl)piperidin-1-yl]-2-propan-2-ylpyrazolo[1,5-a]pyrazine
CID 104733828
2-methyl-1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)pyrrolidine-3-carboxylic acid
CID 104729669
2-[1-(2-tert-butylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]acetic acid
CID 104729582
2-cyclopropyl-4-[3-(fluoromethyl)azetidin-1-yl]pyrazolo[1,5-a]pyrazine
CID 171994745
1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)imidazole-2-carbothioamide
CID 104733768

Frequently Asked Questions

What is the IUPAC name of [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine?
The IUPAC name of [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine (CID 104734304) is [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine.
What is the SMILES notation for [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine?
The canonical SMILES for [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine is CC(C)c1cc2c(N3CC(CN)C3)nccn2n1.
What is the InChIKey of [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine?
The InChIKey is INJNNTCVFZDWHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-9(2)11-5-12-13(15-3-4-18(12)16-11)17-7-10(6-14)8-17/h3-5,9-10H,6-8,14H2,1-2H3.
What are the key properties of [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine?
[1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine has a molecular weight of 245.33 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]methanamine is sourced from PubChem (CID 104734304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).