5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide

C8H8N4O2 — CID 3649375

IUPAC5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide
SMILESNNC(=O)c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C8H8N4O2/c9-10-8(13)6-4-5(11-12-6)7-2-1-3-14-7/h1-4H,9H2,(H,10,13)(H,11,12)
InChIKeyWDPPKVUTTXCXMM-UHFFFAOYSA-N
MW192.18 g/mol
LogP0.27
Rot. Bonds2

About 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide

5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide (PubChem CID 3649375) has the molecular formula C8H8N4O2 and a molecular weight of 192.18 g/mol. Its IUPAC name is 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide.

Molecular Properties

Compound Name5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide
PubChem CID3649375
Molecular FormulaC8H8N4O2
Molecular Weight192.18 g/mol
Exact Mass192.06
IUPAC Name5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide
SMILESNNC(=O)c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C8H8N4O2/c9-10-8(13)6-4-5(11-12-6)7-2-1-3-14-7/h1-4H,9H2,(H,10,13)(H,11,12)
InChIKeyWDPPKVUTTXCXMM-UHFFFAOYSA-N
XLogP0.27
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.18
LogP ≤ 50.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide?
The IUPAC name of 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide (CID 3649375) is 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide.
What is the SMILES notation for 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide?
The canonical SMILES for 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide is NNC(=O)c1cc(-c2ccco2)[nH]n1.
What is the InChIKey of 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide?
The InChIKey is WDPPKVUTTXCXMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2/c9-10-8(13)6-4-5(11-12-6)7-2-1-3-14-7/h1-4H,9H2,(H,10,13)(H,11,12).
What are the key properties of 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide?
5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide has a molecular weight of 192.18 g/mol, XLogP of 0.27, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-1H-pyrazole-3-carbohydrazide is sourced from PubChem (CID 3649375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).