2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide

C13H15N3O2 — CID 892441

IUPAC2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide
SMILESCCn1nccc1C(=O)Nc1ccccc1OC
InChIInChI=1S/C13H15N3O2/c1-3-16-11(8-9-14-16)13(17)15-10-6-4-5-7-12(10)18-2/h4-9H,3H2,1-2H3,(H,15,17)
InChIKeyPGUQRNFLVCBQRG-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.16
Rot. Bonds4

About 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide

2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide (PubChem CID 892441) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide
PubChem CID892441
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide
SMILESCCn1nccc1C(=O)Nc1ccccc1OC
InChIInChI=1S/C13H15N3O2/c1-3-16-11(8-9-14-16)13(17)15-10-6-4-5-7-12(10)18-2/h4-9H,3H2,1-2H3,(H,15,17)
InChIKeyPGUQRNFLVCBQRG-UHFFFAOYSA-N
XLogP2.16
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-ethyl-N-(2-methoxyphenyl)pyrazole-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 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide?
The IUPAC name of 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide (CID 892441) is 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide.
What is the SMILES notation for 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide?
The canonical SMILES for 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide is CCn1nccc1C(=O)Nc1ccccc1OC.
What is the InChIKey of 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide?
The InChIKey is PGUQRNFLVCBQRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-3-16-11(8-9-14-16)13(17)15-10-6-4-5-7-12(10)18-2/h4-9H,3H2,1-2H3,(H,15,17).
What are the key properties of 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide?
2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-methoxyphenyl)pyrazole-3-carboxamide is sourced from PubChem (CID 892441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).