N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide

C16H14N4O5 — CID 18164708

IUPACN-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide
SMILESN#Cc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1ccco1
InChIInChI=1S/C16H14N4O5/c17-8-11-4-1-2-5-12(11)25-10-15(22)20-19-14(21)9-18-16(23)13-6-3-7-24-13/h1-7H,9-10H2,(H,18,23)(H,19,21)(H,20,22)
InChIKeyZBDNBSAOFYJATC-UHFFFAOYSA-N
MW342.31 g/mol
LogP0.11
Rot. Bonds6

About N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide

N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide (PubChem CID 18164708) has the molecular formula C16H14N4O5 and a molecular weight of 342.31 g/mol. Its IUPAC name is N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide
PubChem CID18164708
Molecular FormulaC16H14N4O5
Molecular Weight342.31 g/mol
Exact Mass342.10
IUPAC NameN-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide
SMILESN#Cc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1ccco1
InChIInChI=1S/C16H14N4O5/c17-8-11-4-1-2-5-12(11)25-10-15(22)20-19-14(21)9-18-16(23)13-6-3-7-24-13/h1-7H,9-10H2,(H,18,23)(H,19,21)(H,20,22)
InChIKeyZBDNBSAOFYJATC-UHFFFAOYSA-N
XLogP0.11
TPSA133.46 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.31
LogP ≤ 50.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-tert-butyl-N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]benzamide
CID 4850375
N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]-2-iodobenzamide
CID 35946068
1-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]-3-phenylurea
CID 18292956
N-[2-[2-[2-(4-ethylphenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide
CID 18159228
2-(2-cyanophenoxy)-N-[3-(furan-2-ylmethoxy)propyl]acetamide
CID 51287827
N-[2-[2-(3,5-dimethoxybenzoyl)hydrazinyl]-2-oxoethyl]furan-2-carboxamide
CID 7979811
2-(2-cyanophenoxy)-N-[furan-2-yl(phenyl)methyl]acetamide
CID 51202359
N-[(4-chlorophenyl)methyl]-2-(2-cyanophenoxy)acetamide
CID 2565510
N-[2-[2-(benzylcarbamothioyl)hydrazinyl]-2-oxoethyl]furan-2-carboxamide
CID 7977704
N'-[2-(2-cyanophenoxy)acetyl]-2-[4-(difluoromethoxy)phenyl]acetohydrazide
CID 35947456
N-[4-[4-(2-cyanophenoxy)anilino]-4-oxobutyl]furan-2-carboxamide
CID 86832735
N-[2-oxo-2-(phenylmethoxyamino)ethyl]furan-2-carboxamide
CID 9227365

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide?
The IUPAC name of N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide (CID 18164708) is N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide is N#Cc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1ccco1.
What is the InChIKey of N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide?
The InChIKey is ZBDNBSAOFYJATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O5/c17-8-11-4-1-2-5-12(11)25-10-15(22)20-19-14(21)9-18-16(23)13-6-3-7-24-13/h1-7H,9-10H2,(H,18,23)(H,19,21)(H,20,22).
What are the key properties of N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide?
N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide has a molecular weight of 342.31 g/mol, XLogP of 0.11, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(2-cyanophenoxy)acetyl]hydrazinyl]-2-oxoethyl]furan-2-carboxamide is sourced from PubChem (CID 18164708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).