1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide

C16H17N7O — CID 126901130

IUPAC1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide
SMILESNC(=O)c1cnn(C2CN(c3nccn4nc(C5CC5)cc34)C2)c1
InChIInChI=1S/C16H17N7O/c17-15(24)11-6-19-23(7-11)12-8-21(9-12)16-14-5-13(10-1-2-10)20-22(14)4-3-18-16/h3-7,10,12H,1-2,8-9H2,(H2,17,24)
InChIKeyILQDJKJUTVGNNF-UHFFFAOYSA-N
MW323.36 g/mol
LogP0.96
Rot. Bonds4

About 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide

1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide (PubChem CID 126901130) has the molecular formula C16H17N7O and a molecular weight of 323.36 g/mol. Its IUPAC name is 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide
PubChem CID126901130
Molecular FormulaC16H17N7O
Molecular Weight323.36 g/mol
Exact Mass323.15
IUPAC Name1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide
SMILESNC(=O)c1cnn(C2CN(c3nccn4nc(C5CC5)cc34)C2)c1
InChIInChI=1S/C16H17N7O/c17-15(24)11-6-19-23(7-11)12-8-21(9-12)16-14-5-13(10-1-2-10)20-22(14)4-3-18-16/h3-7,10,12H,1-2,8-9H2,(H2,17,24)
InChIKeyILQDJKJUTVGNNF-UHFFFAOYSA-N
XLogP0.96
TPSA94.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)pyrrolidin-3-yl]pyrazole-4-carboxamide
CID 126948123
N-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-3-yl]-1-methylpyrazole-4-carboxamide
CID 171997253
2-cyclopropyl-4-[3-(fluoromethyl)azetidin-1-yl]pyrazolo[1,5-a]pyrazine
CID 171994745
2-cyclopropyl-4-(3,3-difluoroazetidin-1-yl)pyrazolo[1,5-a]pyrazine
CID 171995190
[4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)morpholin-2-yl]-thiomorpholin-4-ylmethanone
CID 146079752
1-[1-(cycloheptylcarbamoyl)azetidin-3-yl]pyrazole-4-carboxamide
CID 126900915
1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azepan-4-ol
CID 171691218
1-[1-(2-cyclopropylpyrimidin-4-yl)pyrrolidin-3-yl]pyrazole-4-carboxamide
CID 126948101
1-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide
CID 126901107
1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-3-yl]-1,3,3-trimethylurea
CID 166603615
2-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]-1-thiomorpholin-4-ylethanone
CID 171995086
[4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 165434167

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide?
The IUPAC name of 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide (CID 126901130) is 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide.
What is the SMILES notation for 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide?
The canonical SMILES for 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide is NC(=O)c1cnn(C2CN(c3nccn4nc(C5CC5)cc34)C2)c1.
What is the InChIKey of 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide?
The InChIKey is ILQDJKJUTVGNNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N7O/c17-15(24)11-6-19-23(7-11)12-8-21(9-12)16-14-5-13(10-1-2-10)20-22(14)4-3-18-16/h3-7,10,12H,1-2,8-9H2,(H2,17,24).
What are the key properties of 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide?
1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide has a molecular weight of 323.36 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)azetidin-3-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 126901130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).