1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol

C15H20N4O — CID 171691218

IUPAC1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol
SMILESOC1CCCN(c2nccn3nc(C4CC4)cc23)CC1
InChIInChI=1S/C15H20N4O/c20-12-2-1-7-18(8-5-12)15-14-10-13(11-3-4-11)17-19(14)9-6-16-15/h6,9-12,20H,1-5,7-8H2
InChIKeyOVCXEHOGTUJHDQ-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.96
Rot. Bonds2

About 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol

1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol (PubChem CID 171691218) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol.

Molecular Properties

Compound Name1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol
PubChem CID171691218
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol
SMILESOC1CCCN(c2nccn3nc(C4CC4)cc23)CC1
InChIInChI=1S/C15H20N4O/c20-12-2-1-7-18(8-5-12)15-14-10-13(11-3-4-11)17-19(14)9-6-16-15/h6,9-12,20H,1-5,7-8H2
InChIKeyOVCXEHOGTUJHDQ-UHFFFAOYSA-N
XLogP1.96
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclopropyl-4-(4-phenylpiperazin-1-yl)pyrazolo[1,5-a]pyrazine
CID 154830210
2-cyclopropyl-4-(3,3-difluoroazetidin-1-yl)pyrazolo[1,5-a]pyrazine
CID 171995190
[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)pyrrolidin-2-yl]methanol
CID 172905556
1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-3-yl]-1,3,3-trimethylurea
CID 166603615
1-(2-cyclobutylpyrazolo[1,5-a]pyrazin-4-yl)pyrrolidine-3-carbonitrile
CID 166248443
2-cyclopropyl-4-[3-(5-methylpyrimidin-2-yl)oxypiperidin-1-yl]pyrazolo[1,5-a]pyrazine
CID 172903501
2-cyclopropyl-4-[3-(fluoromethyl)azetidin-1-yl]pyrazolo[1,5-a]pyrazine
CID 171994745
2-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]-1-thiomorpholin-4-ylethanone
CID 171995086
5-chloro-N-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]-N-methylpyrimidin-2-amine
CID 155981617
N-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]-6-methylpyrimidin-4-amine
CID 126887880
5-bromo-N-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]-N-methylpyrimidin-2-amine
CID 171328996
N-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-3-yl]-1-methylpyrazole-4-carboxamide
CID 171997253

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol?
The IUPAC name of 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol (CID 171691218) is 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol.
What is the SMILES notation for 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol?
The canonical SMILES for 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol is OC1CCCN(c2nccn3nc(C4CC4)cc23)CC1.
What is the InChIKey of 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol?
The InChIKey is OVCXEHOGTUJHDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c20-12-2-1-7-18(8-5-12)15-14-10-13(11-3-4-11)17-19(14)9-6-16-15/h6,9-12,20H,1-5,7-8H2.
What are the key properties of 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol?
1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol has a molecular weight of 272.35 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol is sourced from PubChem (CID 171691218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).