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

C19H14N4O — CID 58056308

IUPACN-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(Nc1ccccc1-c1ccccc1)c1cnn2cccnc12
InChIInChI=1S/C19H14N4O/c24-19(16-13-21-23-12-6-11-20-18(16)23)22-17-10-5-4-9-15(17)14-7-2-1-3-8-14/h1-13H,(H,22,24)
InChIKeyFYTQESPERLZYAD-UHFFFAOYSA-N
MW314.35 g/mol
LogP3.65
Rot. Bonds3

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

N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 58056308) has the molecular formula C19H14N4O and a molecular weight of 314.35 g/mol. Its IUPAC name is N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID58056308
Molecular FormulaC19H14N4O
Molecular Weight314.35 g/mol
Exact Mass314.12
IUPAC NameN-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(Nc1ccccc1-c1ccccc1)c1cnn2cccnc12
InChIInChI=1S/C19H14N4O/c24-19(16-13-21-23-12-6-11-20-18(16)23)22-17-10-5-4-9-15(17)14-7-2-1-3-8-14/h1-13H,(H,22,24)
InChIKeyFYTQESPERLZYAD-UHFFFAOYSA-N
XLogP3.65
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 58056308) is N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(Nc1ccccc1-c1ccccc1)c1cnn2cccnc12.
What is the InChIKey of N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is FYTQESPERLZYAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O/c24-19(16-13-21-23-12-6-11-20-18(16)23)22-17-10-5-4-9-15(17)14-7-2-1-3-8-14/h1-13H,(H,22,24).
What are the key properties of N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 314.35 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 58056308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).