1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide

C15H19N3O2 — CID 110373151

IUPAC1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide
SMILESCCCNC(=O)c1cc(C)n(-c2cccc(OC)c2)n1
InChIInChI=1S/C15H19N3O2/c1-4-8-16-15(19)14-9-11(2)18(17-14)12-6-5-7-13(10-12)20-3/h5-7,9-10H,4,8H2,1-3H3,(H,16,19)
InChIKeyTZLFAVSELKLHGU-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.33
Rot. Bonds5

About 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide

1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide (PubChem CID 110373151) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide
PubChem CID110373151
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide
SMILESCCCNC(=O)c1cc(C)n(-c2cccc(OC)c2)n1
InChIInChI=1S/C15H19N3O2/c1-4-8-16-15(19)14-9-11(2)18(17-14)12-6-5-7-13(10-12)20-3/h5-7,9-10H,4,8H2,1-3H3,(H,16,19)
InChIKeyTZLFAVSELKLHGU-UHFFFAOYSA-N
XLogP2.33
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide?
The IUPAC name of 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide (CID 110373151) is 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide.
What is the SMILES notation for 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide?
The canonical SMILES for 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide is CCCNC(=O)c1cc(C)n(-c2cccc(OC)c2)n1.
What is the InChIKey of 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide?
The InChIKey is TZLFAVSELKLHGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-4-8-16-15(19)14-9-11(2)18(17-14)12-6-5-7-13(10-12)20-3/h5-7,9-10H,4,8H2,1-3H3,(H,16,19).
What are the key properties of 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide?
1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-5-methyl-N-propylpyrazole-3-carboxamide is sourced from PubChem (CID 110373151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).