N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide

C15H14N4O2 — CID 53040757

IUPACN-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCOc1cccc(NC(=O)c2cc(C)n3nccc3n2)c1
InChIInChI=1S/C15H14N4O2/c1-10-8-13(18-14-6-7-16-19(10)14)15(20)17-11-4-3-5-12(9-11)21-2/h3-9H,1-2H3,(H,17,20)
InChIKeyUEOHVSVQHXKKBX-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.30
Rot. Bonds3

About N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide

N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 53040757) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID53040757
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC NameN-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCOc1cccc(NC(=O)c2cc(C)n3nccc3n2)c1
InChIInChI=1S/C15H14N4O2/c1-10-8-13(18-14-6-7-16-19(10)14)15(20)17-11-4-3-5-12(9-11)21-2/h3-9H,1-2H3,(H,17,20)
InChIKeyUEOHVSVQHXKKBX-UHFFFAOYSA-N
XLogP2.30
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 53040757) is N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide is COc1cccc(NC(=O)c2cc(C)n3nccc3n2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is UEOHVSVQHXKKBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-10-8-13(18-14-6-7-16-19(10)14)15(20)17-11-4-3-5-12(9-11)21-2/h3-9H,1-2H3,(H,17,20).
What are the key properties of N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 53040757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).