6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C18H15N5O2 — CID 134708782

IUPAC6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)Nc3onc(-c4ccccc4)c3C)cnn2c1
InChIInChI=1S/C18H15N5O2/c1-11-8-19-16-14(9-20-23(16)10-11)17(24)21-18-12(2)15(22-25-18)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,21,24)
InChIKeyUQOKQUTYTMTGAW-UHFFFAOYSA-N
MW333.35 g/mol
LogP3.25
Rot. Bonds3

About 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 134708782) has the molecular formula C18H15N5O2 and a molecular weight of 333.35 g/mol. Its IUPAC name is 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID134708782
Molecular FormulaC18H15N5O2
Molecular Weight333.35 g/mol
Exact Mass333.12
IUPAC Name6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)Nc3onc(-c4ccccc4)c3C)cnn2c1
InChIInChI=1S/C18H15N5O2/c1-11-8-19-16-14(9-20-23(16)10-11)17(24)21-18-12(2)15(22-25-18)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,21,24)
InChIKeyUQOKQUTYTMTGAW-UHFFFAOYSA-N
XLogP3.25
TPSA85.32 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.35
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 134708782) is 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cnc2c(C(=O)Nc3onc(-c4ccccc4)c3C)cnn2c1.
What is the InChIKey of 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is UQOKQUTYTMTGAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O2/c1-11-8-19-16-14(9-20-23(16)10-11)17(24)21-18-12(2)15(22-25-18)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,21,24).
What are the key properties of 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 333.35 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(4-methyl-3-phenyl-1,2-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 134708782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).