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

C16H21N5O — CID 134796618

IUPACN-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCN(c2ccnc3ccnn23)C1)C1CCCC1
InChIInChI=1S/C16H21N5O/c22-16(12-3-1-2-4-12)19-13-7-10-20(11-13)15-6-8-17-14-5-9-18-21(14)15/h5-6,8-9,12-13H,1-4,7,10-11H2,(H,19,22)
InChIKeyXYAHFWJNXQSBFY-UHFFFAOYSA-N
MW299.38 g/mol
LogP1.61
Rot. Bonds3

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

N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide (PubChem CID 134796618) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide
PubChem CID134796618
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC NameN-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCN(c2ccnc3ccnn23)C1)C1CCCC1
InChIInChI=1S/C16H21N5O/c22-16(12-3-1-2-4-12)19-13-7-10-20(11-13)15-6-8-17-14-5-9-18-21(14)15/h5-6,8-9,12-13H,1-4,7,10-11H2,(H,19,22)
InChIKeyXYAHFWJNXQSBFY-UHFFFAOYSA-N
XLogP1.61
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide?
The IUPAC name of N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide (CID 134796618) is N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide is O=C(NC1CCN(c2ccnc3ccnn23)C1)C1CCCC1.
What is the InChIKey of N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide?
The InChIKey is XYAHFWJNXQSBFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O/c22-16(12-3-1-2-4-12)19-13-7-10-20(11-13)15-6-8-17-14-5-9-18-21(14)15/h5-6,8-9,12-13H,1-4,7,10-11H2,(H,19,22).
What are the key properties of N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide?
N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide has a molecular weight of 299.38 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)cyclopentanecarboxamide is sourced from PubChem (CID 134796618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).