(2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal

C9H9FN2O — CID 86614651

IUPAC(2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal
SMILESC/C(C=O)=N/Nc1ccc(F)cc1
InChIInChI=1S/C9H9FN2O/c1-7(6-13)11-12-9-4-2-8(10)3-5-9/h2-6,12H,1H3/b11-7-
InChIKeyRVDJKFONUNYECQ-XFFZJAGNSA-N
MW180.18 g/mol
LogP1.81
Rot. Bonds3

About (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal

(2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal (PubChem CID 86614651) has the molecular formula C9H9FN2O and a molecular weight of 180.18 g/mol. Its IUPAC name is (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal.

Molecular Properties

Compound Name(2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal
PubChem CID86614651
Molecular FormulaC9H9FN2O
Molecular Weight180.18 g/mol
Exact Mass180.07
IUPAC Name(2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal
SMILESC/C(C=O)=N/Nc1ccc(F)cc1
InChIInChI=1S/C9H9FN2O/c1-7(6-13)11-12-9-4-2-8(10)3-5-9/h2-6,12H,1H3/b11-7-
InChIKeyRVDJKFONUNYECQ-XFFZJAGNSA-N
XLogP1.81
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.18
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2E)-2-[(4-fluorophenyl)hydrazinylidene]propanoic acid
CID 156507863
4-[(2Z)-2-[1-(4-fluorophenyl)ethylidene]hydrazinyl]benzoate
CID 7761403
2-[(4-fluorophenyl)hydrazinylidene]propanedinitrile
CID 832904
(1Z)-N,2-bis(4-fluorophenyl)-2-oxoethanehydrazonoyl chloride
CID 138391833
N-(4-fluoroanilino)-3-methyl-2-oxobutanimidoyl cyanide
CID 538555
2-[(4-fluorophenyl)hydrazinylidene]-2-(3-oxo-4H-quinoxalin-2-yl)acetaldehyde
CID 3568770
N-(4-fluorophenyl)-N'-(propan-2-ylideneamino)oxamide
CID 2854967
(2Z)-2-amino-2-[(4-fluorophenyl)hydrazinylidene]-N-phenylacetamide
CID 134920026
N-[4-(4-fluorophenyl)phenyl]acetamide
CID 9812
4-chloro-2-[(Z)-N-(4-fluoroanilino)-C-methylcarbonimidoyl]-N-methylaniline
CID 91332262
(NE)-N-[(2E)-2-[(4-bromophenyl)hydrazinylidene]propylidene]hydroxylamine;ethane;methane
CID 171625948
(2Z)-2-(benzenesulfonyl)-2-[(4-fluorophenyl)hydrazinylidene]acetohydrazide
CID 5407441

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal?
The IUPAC name of (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal (CID 86614651) is (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal.
What is the SMILES notation for (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal?
The canonical SMILES for (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal is C/C(C=O)=N/Nc1ccc(F)cc1.
What is the InChIKey of (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal?
The InChIKey is RVDJKFONUNYECQ-XFFZJAGNSA-N. The full InChI is InChI=1S/C9H9FN2O/c1-7(6-13)11-12-9-4-2-8(10)3-5-9/h2-6,12H,1H3/b11-7-.
What are the key properties of (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal?
(2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal has a molecular weight of 180.18 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(4-fluorophenyl)hydrazinylidene]propanal is sourced from PubChem (CID 86614651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).