N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide

C15H13N3O2 — CID 8867965

IUPACN-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide
SMILESO=C(NCc1ccco1)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C15H13N3O2/c19-15(16-10-12-7-4-8-20-12)14-9-13(17-18-14)11-5-2-1-3-6-11/h1-9H,10H2,(H,16,19)(H,17,18)
InChIKeyGKUNTQALYUVTFI-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.60
Rot. Bonds4

About N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide

N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide (PubChem CID 8867965) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide
PubChem CID8867965
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC NameN-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide
SMILESO=C(NCc1ccco1)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C15H13N3O2/c19-15(16-10-12-7-4-8-20-12)14-9-13(17-18-14)11-5-2-1-3-6-11/h1-9H,10H2,(H,16,19)(H,17,18)
InChIKeyGKUNTQALYUVTFI-UHFFFAOYSA-N
XLogP2.60
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-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-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide (CID 8867965) is N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide is O=C(NCc1ccco1)c1cc(-c2ccccc2)n[nH]1.
What is the InChIKey of N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide?
The InChIKey is GKUNTQALYUVTFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c19-15(16-10-12-7-4-8-20-12)14-9-13(17-18-14)11-5-2-1-3-6-11/h1-9H,10H2,(H,16,19)(H,17,18).
What are the key properties of N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide?
N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-3-phenyl-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 8867965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).