N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C11H14N4O — CID 19414507

IUPACN-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC(C)CNC(=O)c1cnn2cccnc12
InChIInChI=1S/C11H14N4O/c1-8(2)6-13-11(16)9-7-14-15-5-3-4-12-10(9)15/h3-5,7-8H,6H2,1-2H3,(H,13,16)
InChIKeyCZHLXYQYLNRYAL-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.12
Rot. Bonds3

About N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 19414507) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID19414507
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC NameN-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC(C)CNC(=O)c1cnn2cccnc12
InChIInChI=1S/C11H14N4O/c1-8(2)6-13-11(16)9-7-14-15-5-3-4-12-10(9)15/h3-5,7-8H,6H2,1-2H3,(H,13,16)
InChIKeyCZHLXYQYLNRYAL-UHFFFAOYSA-N
XLogP1.12
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 19414507) is N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CC(C)CNC(=O)c1cnn2cccnc12.
What is the InChIKey of N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is CZHLXYQYLNRYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8(2)6-13-11(16)9-7-14-15-5-3-4-12-10(9)15/h3-5,7-8H,6H2,1-2H3,(H,13,16).
What are the key properties of N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 218.26 g/mol, XLogP of 1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 19414507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).