2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide

C15H21N5O — CID 134798557

IUPAC2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide
SMILESCC(C)(C)C(=O)NC1CCN(c2ccnc3ccnn23)C1
InChIInChI=1S/C15H21N5O/c1-15(2,3)14(21)18-11-6-9-19(10-11)13-5-7-16-12-4-8-17-20(12)13/h4-5,7-8,11H,6,9-10H2,1-3H3,(H,18,21)
InChIKeyMZIVMGXOVNBRTO-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.47
Rot. Bonds2

About 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide

2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide (PubChem CID 134798557) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide
PubChem CID134798557
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide
SMILESCC(C)(C)C(=O)NC1CCN(c2ccnc3ccnn23)C1
InChIInChI=1S/C15H21N5O/c1-15(2,3)14(21)18-11-6-9-19(10-11)13-5-7-16-12-4-8-17-20(12)13/h4-5,7-8,11H,6,9-10H2,1-3H3,(H,18,21)
InChIKeyMZIVMGXOVNBRTO-UHFFFAOYSA-N
XLogP1.47
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide (CID 134798557) is 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide is CC(C)(C)C(=O)NC1CCN(c2ccnc3ccnn23)C1.
What is the InChIKey of 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide?
The InChIKey is MZIVMGXOVNBRTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-15(2,3)14(21)18-11-6-9-19(10-11)13-5-7-16-12-4-8-17-20(12)13/h4-5,7-8,11H,6,9-10H2,1-3H3,(H,18,21).
What are the key properties of 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide?
2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide has a molecular weight of 287.37 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)propanamide is sourced from PubChem (CID 134798557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).