N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide

C14H11FN4O2 — CID 6019949

IUPACN-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide
SMILESO=C(N/N=C\c1ccncc1)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C14H11FN4O2/c15-11-1-3-12(4-2-11)18-13(20)14(21)19-17-9-10-5-7-16-8-6-10/h1-9H,(H,18,20)(H,19,21)/b17-9-
InChIKeyCVIQCAPJZGBUJM-MFOYZWKCSA-N
MW286.27 g/mol
LogP1.31
Rot. Bonds3

About N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide

N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide (PubChem CID 6019949) has the molecular formula C14H11FN4O2 and a molecular weight of 286.27 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide
PubChem CID6019949
Molecular FormulaC14H11FN4O2
Molecular Weight286.27 g/mol
Exact Mass286.09
IUPAC NameN-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide
SMILESO=C(N/N=C\c1ccncc1)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C14H11FN4O2/c15-11-1-3-12(4-2-11)18-13(20)14(21)19-17-9-10-5-7-16-8-6-10/h1-9H,(H,18,20)(H,19,21)/b17-9-
InChIKeyCVIQCAPJZGBUJM-MFOYZWKCSA-N
XLogP1.31
TPSA83.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.27
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', '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

N-(3,4-dichlorophenyl)-N'-[(4-fluorophenyl)methylideneamino]oxamide
CID 2063705
N-(4-phenoxyphenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide
CID 94833523
N-(4-fluorophenyl)-N'-[(4-nitrophenyl)methylideneamino]oxamide
CID 4187128
N'-[(Z)-(4-fluorophenyl)methylideneamino]-N-methyloxamide
CID 94844116
N'-[(E)-naphthalen-2-ylmethylideneamino]-N-pyridin-4-yloxamide
CID 154631892
N-(4-fluorophenyl)-N'-[(Z)-(4-propoxyphenyl)methylideneamino]oxamide
CID 8988930
1-[(Z)-pyridin-4-ylmethylideneamino]-3-[(E)-pyridin-4-ylmethylideneamino]urea
CID 54600785
[(E)-pyridin-4-ylmethylideneamino]carbamic acid
CID 19830229
N'-(4-fluorophenyl)-N-(4-pyridin-4-yloxyphenyl)oxamide
CID 11439538
3-(4-fluorophenyl)-N-(pyridin-4-ylmethylideneamino)-1H-pyrazole-5-carboxamide
CID 761755
N-(3-fluorophenyl)-N'-[(4-iodophenyl)methylideneamino]oxamide
CID 4570799
[(E)-pyridin-4-ylmethylideneamino]carbamic acid;hydrate
CID 88512822

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide?
The IUPAC name of N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide (CID 6019949) is N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide.
What is the SMILES notation for N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide?
The canonical SMILES for N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide is O=C(N/N=C\c1ccncc1)C(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide?
The InChIKey is CVIQCAPJZGBUJM-MFOYZWKCSA-N. The full InChI is InChI=1S/C14H11FN4O2/c15-11-1-3-12(4-2-11)18-13(20)14(21)19-17-9-10-5-7-16-8-6-10/h1-9H,(H,18,20)(H,19,21)/b17-9-.
What are the key properties of N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide?
N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide has a molecular weight of 286.27 g/mol, XLogP of 1.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide is sourced from PubChem (CID 6019949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).