2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide

C15H12N4O2 — CID 7032347

IUPAC2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
SMILESN#Cc1ccccc1OCC(=O)N/N=C\c1cccnc1
InChIInChI=1S/C15H12N4O2/c16-8-13-5-1-2-6-14(13)21-11-15(20)19-18-10-12-4-3-7-17-9-12/h1-7,9-10H,11H2,(H,19,20)/b18-10-
InChIKeyMOKSQEMFWXRGIB-ZDLGFXPLSA-N
MW280.29 g/mol
LogP1.48
Rot. Bonds5

About 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide

2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide (PubChem CID 7032347) has the molecular formula C15H12N4O2 and a molecular weight of 280.29 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
PubChem CID7032347
Molecular FormulaC15H12N4O2
Molecular Weight280.29 g/mol
Exact Mass280.10
IUPAC Name2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
SMILESN#Cc1ccccc1OCC(=O)N/N=C\c1cccnc1
InChIInChI=1S/C15H12N4O2/c16-8-13-5-1-2-6-14(13)21-11-15(20)19-18-10-12-4-3-7-17-9-12/h1-7,9-10H,11H2,(H,19,20)/b18-10-
InChIKeyMOKSQEMFWXRGIB-ZDLGFXPLSA-N
XLogP1.48
TPSA87.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.29
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(benzylideneamino)-2-(2-cyanophenoxy)acetamide
CID 789568
2-(2-cyanophenoxy)-N-[(E)-[3-[(E)-[[2-(2-cyanophenoxy)acetyl]hydrazinylidene]methyl]phenyl]methylideneamino]acetamide
CID 42995701
2-(2-chlorophenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 6863841
N-[(Z)-(4-chlorophenyl)methylideneamino]-2-(2-cyanophenoxy)acetamide
CID 5392514
4-[[[2-(2-cyanophenoxy)acetyl]hydrazinylidene]methyl]benzoic acid
CID 110209219
2-(2-cyanophenoxy)-N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide
CID 7038076
2-(2-tert-butylphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 19190191
2-(2-prop-2-enylphenoxy)-N-(pyridin-3-ylmethylideneamino)acetamide
CID 935509
2-[2-[(E)-2-(4-nitrophenyl)ethenyl]phenoxy]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 10668794
2-(2-cyanophenoxy)-N-[(2,6-dichlorophenyl)methylideneamino]acetamide
CID 780706
2-(2-cyanophenoxy)-N-[(Z)-(2-nitrophenyl)methylideneamino]acetamide
CID 9467550
N-[(Z)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]-2-(2-cyanophenoxy)acetamide
CID 9467627

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide (CID 7032347) is 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide is N#Cc1ccccc1OCC(=O)N/N=C\c1cccnc1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide?
The InChIKey is MOKSQEMFWXRGIB-ZDLGFXPLSA-N. The full InChI is InChI=1S/C15H12N4O2/c16-8-13-5-1-2-6-14(13)21-11-15(20)19-18-10-12-4-3-7-17-9-12/h1-7,9-10H,11H2,(H,19,20)/b18-10-.
What are the key properties of 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide?
2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide has a molecular weight of 280.29 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide is sourced from PubChem (CID 7032347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).