N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide

C15H14N4O2 — CID 110851660

IUPACN-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccnc3ccnn23)cc1
InChIInChI=1S/C15H14N4O2/c1-21-12-4-2-11(3-5-12)10-17-15(20)13-6-8-16-14-7-9-18-19(13)14/h2-9H,10H2,1H3,(H,17,20)
InChIKeyQATLKUCCZWNTFL-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.67
Rot. Bonds4

About N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide

N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide (PubChem CID 110851660) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide
PubChem CID110851660
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC NameN-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccnc3ccnn23)cc1
InChIInChI=1S/C15H14N4O2/c1-21-12-4-2-11(3-5-12)10-17-15(20)13-6-8-16-14-7-9-18-19(13)14/h2-9H,10H2,1H3,(H,17,20)
InChIKeyQATLKUCCZWNTFL-UHFFFAOYSA-N
XLogP1.67
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 110851345
N-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-5-carboxamide
CID 110851649
N-[(4-methoxyphenyl)methyl]-4-methylpyridine-2-carboxamide
CID 110851612
N-[(4-methoxyphenyl)methyl]-1,2-oxazole-3-carboxamide
CID 110693720
4-chloro-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 7802633
2-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]pyrazole-3-carboxamide
CID 174965768
N-[(4-methoxyphenyl)methyl]-1-propyl-4-pyridin-4-ylpyrrole-2-carboxamide
CID 71840926
N-[2-(4-methoxyphenoxy)ethyl]-2-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 84575522
dimethyl pyrazolo[1,5-a]pyrimidine-5,7-dicarboxylate;methane;methyl 7-[(3-chloro-4-fluorophenyl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidine-5-carboxylate
CID 158473485
N-[(4-methoxyphenyl)methyl]quinoxaline-5-carboxamide
CID 110701358
N-[(4-methoxyphenyl)methyl]-1-methylpyrrolo[2,3-b]pyridine-3-carboxamide
CID 53162853
N-[(4-methoxyphenyl)methyl]-6-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carboxamide
CID 164616105

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide (CID 110851660) is N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide is COc1ccc(CNC(=O)c2ccnc3ccnn23)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide?
The InChIKey is QATLKUCCZWNTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-21-12-4-2-11(3-5-12)10-17-15(20)13-6-8-16-14-7-9-18-19(13)14/h2-9H,10H2,1H3,(H,17,20).
What are the key properties of N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide?
N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide is sourced from PubChem (CID 110851660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).