N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide

C11H13N5O — CID 119317627

IUPACN-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide
SMILESO=C(Nc1ccnc2ccnn12)C1CCCN1
InChIInChI=1S/C11H13N5O/c17-11(8-2-1-5-12-8)15-10-3-6-13-9-4-7-14-16(9)10/h3-4,6-8,12H,1-2,5H2,(H,15,17)
InChIKeyCZMGFAAYWAWKQA-UHFFFAOYSA-N
MW231.26 g/mol
LogP0.42
Rot. Bonds2

About N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide

N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide (PubChem CID 119317627) has the molecular formula C11H13N5O and a molecular weight of 231.26 g/mol. Its IUPAC name is N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide
PubChem CID119317627
Molecular FormulaC11H13N5O
Molecular Weight231.26 g/mol
Exact Mass231.11
IUPAC NameN-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide
SMILESO=C(Nc1ccnc2ccnn12)C1CCCN1
InChIInChI=1S/C11H13N5O/c17-11(8-2-1-5-12-8)15-10-3-6-13-9-4-7-14-16(9)10/h3-4,6-8,12H,1-2,5H2,(H,15,17)
InChIKeyCZMGFAAYWAWKQA-UHFFFAOYSA-N
XLogP0.42
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide?
The IUPAC name of N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide (CID 119317627) is N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide?
The canonical SMILES for N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide is O=C(Nc1ccnc2ccnn12)C1CCCN1.
What is the InChIKey of N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide?
The InChIKey is CZMGFAAYWAWKQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O/c17-11(8-2-1-5-12-8)15-10-3-6-13-9-4-7-14-16(9)10/h3-4,6-8,12H,1-2,5H2,(H,15,17).
What are the key properties of N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide?
N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide has a molecular weight of 231.26 g/mol, XLogP of 0.42, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 119317627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).