N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide

C15H19N3O2 — CID 122265941

IUPACN-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide
SMILESO=C(NCC(c1ccco1)n1cccn1)C1CCCC1
InChIInChI=1S/C15H19N3O2/c19-15(12-5-1-2-6-12)16-11-13(14-7-3-10-20-14)18-9-4-8-17-18/h3-4,7-10,12-13H,1-2,5-6,11H2,(H,16,19)
InChIKeyQHQQNSDPKKILLT-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.37
Rot. Bonds5

About N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide

N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide (PubChem CID 122265941) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide
PubChem CID122265941
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide
SMILESO=C(NCC(c1ccco1)n1cccn1)C1CCCC1
InChIInChI=1S/C15H19N3O2/c19-15(12-5-1-2-6-12)16-11-13(14-7-3-10-20-14)18-9-4-8-17-18/h3-4,7-10,12-13H,1-2,5-6,11H2,(H,16,19)
InChIKeyQHQQNSDPKKILLT-UHFFFAOYSA-N
XLogP2.37
TPSA60.06 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 ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide?
The IUPAC name of N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide (CID 122265941) is N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide is O=C(NCC(c1ccco1)n1cccn1)C1CCCC1.
What is the InChIKey of N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide?
The InChIKey is QHQQNSDPKKILLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c19-15(12-5-1-2-6-12)16-11-13(14-7-3-10-20-14)18-9-4-8-17-18/h3-4,7-10,12-13H,1-2,5-6,11H2,(H,16,19).
What are the key properties of N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide?
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide has a molecular weight of 273.34 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide is sourced from PubChem (CID 122265941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).