N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride

C6H7FNO- — CID 139243614

IUPACN-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride
SMILESONC=C1C=CC=C1.[F-]
InChIInChI=1S/C6H7NO.FH/c8-7-5-6-3-1-2-4-6;/h1-5,7-8H;1H/p-1
InChIKeyOBNZHRDDXSIPJD-UHFFFAOYSA-M
MW128.13 g/mol
LogP-2.02
Rot. Bonds1

About N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride

N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride (PubChem CID 139243614) has the molecular formula C6H7FNO- and a molecular weight of 128.13 g/mol. Its IUPAC name is N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride.

Molecular Properties

Compound NameN-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride
PubChem CID139243614
Molecular FormulaC6H7FNO-
Molecular Weight128.13 g/mol
Exact Mass128.05
IUPAC NameN-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride
SMILESONC=C1C=CC=C1.[F-]
InChIInChI=1S/C6H7NO.FH/c8-7-5-6-3-1-2-4-6;/h1-5,7-8H;1H/p-1
InChIKeyOBNZHRDDXSIPJD-UHFFFAOYSA-M
XLogP-2.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 5-2.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

cyclopenta-2,4-dien-1-ylidenemethanol fluoride
CID 139243616
cyclopenta-2,4-dien-1-ylidenemethanamine fluoride
CID 139243613
dibutyltin;(6Z)-6-[(hydroxyamino)methylidene]cyclohexa-2,4-dien-1-one
CID 5388208
5-(1-tritioethylidene)cyclopenta-1,3-diene
CID 58905763
cyclopenta-2,4-dien-1-ylidenemethyl formate
CID 174902385
1-cyclopenta-2,4-dien-1-ylidene-3-methylbut-2-en-1-ol
CID 140977465
5-penta-1,4-dien-3-ylidenecyclopenta-1,3-diene
CID 18349422
N-[(1E,3E)-5-phenyliminopenta-1,3-dienyl]hydroxylamine
CID 10726275
N-hydroxy-N'-(3-methylphenyl)methanimidamide
CID 20763605
N'-(3-chlorophenyl)-N-hydroxymethanimidamide
CID 20763326
(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-(4-iodophenyl)prop-1-en-1-ol
CID 139234487
2-(3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl)benzene-1,3,5-triol
CID 161072337

Frequently Asked Questions

What is the IUPAC name of N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride?
The IUPAC name of N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride (CID 139243614) is N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride.
What is the SMILES notation for N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride?
The canonical SMILES for N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride is ONC=C1C=CC=C1.[F-].
What is the InChIKey of N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride?
The InChIKey is OBNZHRDDXSIPJD-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H7NO.FH/c8-7-5-6-3-1-2-4-6;/h1-5,7-8H;1H/p-1.
What are the key properties of N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride?
N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride has a molecular weight of 128.13 g/mol, XLogP of -2.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopenta-2,4-dien-1-ylidenemethyl)hydroxylamine fluoride is sourced from PubChem (CID 139243614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).