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

C17H20N4O — CID 19414526

IUPACN-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NC1C2CC3CC(C2)CC1C3)c1cnn2cccnc12
InChIInChI=1S/C17H20N4O/c22-17(14-9-19-21-3-1-2-18-16(14)21)20-15-12-5-10-4-11(7-12)8-13(15)6-10/h1-3,9-13,15H,4-8H2,(H,20,22)
InChIKeyQZFFAYREXADHGJ-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.28
Rot. Bonds2

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

N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 19414526) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID19414526
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC NameN-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NC1C2CC3CC(C2)CC1C3)c1cnn2cccnc12
InChIInChI=1S/C17H20N4O/c22-17(14-9-19-21-3-1-2-18-16(14)21)20-15-12-5-10-4-11(7-12)8-13(15)6-10/h1-3,9-13,15H,4-8H2,(H,20,22)
InChIKeyQZFFAYREXADHGJ-UHFFFAOYSA-N
XLogP2.28
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 19414526) is N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(NC1C2CC3CC(C2)CC1C3)c1cnn2cccnc12.
What is the InChIKey of N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is QZFFAYREXADHGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c22-17(14-9-19-21-3-1-2-18-16(14)21)20-15-12-5-10-4-11(7-12)8-13(15)6-10/h1-3,9-13,15H,4-8H2,(H,20,22).
What are the key properties of N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 19414526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).