N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide

C14H14N4O2 — CID 2234048

IUPACN-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1cc(C)n2nc(C(=O)NCc3ccco3)cc2n1
InChIInChI=1S/C14H14N4O2/c1-9-6-10(2)18-13(16-9)7-12(17-18)14(19)15-8-11-4-3-5-20-11/h3-7H,8H2,1-2H3,(H,15,19)
InChIKeyPDTSWVJZGDNGRA-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.87
Rot. Bonds3

About N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide

N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 2234048) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID2234048
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC NameN-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1cc(C)n2nc(C(=O)NCc3ccco3)cc2n1
InChIInChI=1S/C14H14N4O2/c1-9-6-10(2)18-13(16-9)7-12(17-18)14(19)15-8-11-4-3-5-20-11/h3-7H,8H2,1-2H3,(H,15,19)
InChIKeyPDTSWVJZGDNGRA-UHFFFAOYSA-N
XLogP1.87
TPSA72.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 2234048) is N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide is Cc1cc(C)n2nc(C(=O)NCc3ccco3)cc2n1.
What is the InChIKey of N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is PDTSWVJZGDNGRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c1-9-6-10(2)18-13(16-9)7-12(17-18)14(19)15-8-11-4-3-5-20-11/h3-7H,8H2,1-2H3,(H,15,19).
What are the key properties of N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide?
N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 2234048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).