N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide

C14H19N3O2 — CID 47343724

IUPACN-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2cc(C(C)(C)C)[nH]n2)o1
InChIInChI=1S/C14H19N3O2/c1-5-9-6-7-10(19-9)13(18)15-12-8-11(16-17-12)14(2,3)4/h6-8H,5H2,1-4H3,(H2,15,16,17,18)
InChIKeyVFDUDCUUZDOSBM-UHFFFAOYSA-N
MW261.32 g/mol
LogP3.11
Rot. Bonds3

About N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide

N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide (PubChem CID 47343724) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide
PubChem CID47343724
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2cc(C(C)(C)C)[nH]n2)o1
InChIInChI=1S/C14H19N3O2/c1-5-9-6-7-10(19-9)13(18)15-12-8-11(16-17-12)14(2,3)4/h6-8H,5H2,1-4H3,(H2,15,16,17,18)
InChIKeyVFDUDCUUZDOSBM-UHFFFAOYSA-N
XLogP3.11
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-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 N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide?
The IUPAC name of N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide (CID 47343724) is N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide.
What is the SMILES notation for N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide?
The canonical SMILES for N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide is CCc1ccc(C(=O)Nc2cc(C(C)(C)C)[nH]n2)o1.
What is the InChIKey of N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide?
The InChIKey is VFDUDCUUZDOSBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-5-9-6-7-10(19-9)13(18)15-12-8-11(16-17-12)14(2,3)4/h6-8H,5H2,1-4H3,(H2,15,16,17,18).
What are the key properties of N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide?
N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide has a molecular weight of 261.32 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide is sourced from PubChem (CID 47343724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).