N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide

C5H10FN3O2 — CID 130504892

IUPACN-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide
SMILESNNC(=O)C(=O)NCCCF
InChIInChI=1S/C5H10FN3O2/c6-2-1-3-8-4(10)5(11)9-7/h1-3,7H2,(H,8,10)(H,9,11)
InChIKeyBKUXTTQDBMUBLA-UHFFFAOYSA-N
MW163.15 g/mol
LogP-1.55
Rot. Bonds3

About N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide

N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide (PubChem CID 130504892) has the molecular formula C5H10FN3O2 and a molecular weight of 163.15 g/mol. Its IUPAC name is N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide.

Molecular Properties

Compound NameN-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide
PubChem CID130504892
Molecular FormulaC5H10FN3O2
Molecular Weight163.15 g/mol
Exact Mass163.08
IUPAC NameN-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide
SMILESNNC(=O)C(=O)NCCCF
InChIInChI=1S/C5H10FN3O2/c6-2-1-3-8-4(10)5(11)9-7/h1-3,7H2,(H,8,10)(H,9,11)
InChIKeyBKUXTTQDBMUBLA-UHFFFAOYSA-N
XLogP-1.55
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.15
LogP ≤ 5-1.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', '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 N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide?
The IUPAC name of N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide (CID 130504892) is N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide.
What is the SMILES notation for N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide?
The canonical SMILES for N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide is NNC(=O)C(=O)NCCCF.
What is the InChIKey of N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide?
The InChIKey is BKUXTTQDBMUBLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FN3O2/c6-2-1-3-8-4(10)5(11)9-7/h1-3,7H2,(H,8,10)(H,9,11).
What are the key properties of N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide?
N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide has a molecular weight of 163.15 g/mol, XLogP of -1.55, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoropropyl)-2-hydrazinyl-2-oxoacetamide is sourced from PubChem (CID 130504892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).