2-anilino-N-(furan-2-ylmethylideneamino)acetamide

C13H13N3O2 — CID 3757182

IUPAC2-anilino-N-(furan-2-ylmethylideneamino)acetamide
SMILESO=C(CNc1ccccc1)NN=Cc1ccco1
InChIInChI=1S/C13H13N3O2/c17-13(10-14-11-5-2-1-3-6-11)16-15-9-12-7-4-8-18-12/h1-9,14H,10H2,(H,16,17)
InChIKeyQWULNYGKIRRUJD-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.84
Rot. Bonds5

About 2-anilino-N-(furan-2-ylmethylideneamino)acetamide

2-anilino-N-(furan-2-ylmethylideneamino)acetamide (PubChem CID 3757182) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is 2-anilino-N-(furan-2-ylmethylideneamino)acetamide.

Molecular Properties

Compound Name2-anilino-N-(furan-2-ylmethylideneamino)acetamide
PubChem CID3757182
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Name2-anilino-N-(furan-2-ylmethylideneamino)acetamide
SMILESO=C(CNc1ccccc1)NN=Cc1ccco1
InChIInChI=1S/C13H13N3O2/c17-13(10-14-11-5-2-1-3-6-11)16-15-9-12-7-4-8-18-12/h1-9,14H,10H2,(H,16,17)
InChIKeyQWULNYGKIRRUJD-UHFFFAOYSA-N
XLogP1.84
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-(4-bromoanilino)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
CID 5404211
2-(4-fluoroanilino)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
CID 5404241
2-(3,4-dimethylanilino)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
CID 5426354
2-(3,5-dibromo-4-methylanilino)-N-[(E)-furan-2-ylmethylideneamino]acetamide
CID 6039229
(E)-N-[(E)-furan-2-ylmethylideneamino]-N'-[(Z)-furan-2-ylmethylideneamino]hex-3-enediamide
CID 45050499
N,N'-bis(furan-2-ylmethylideneamino)decanediamide
CID 5226719
N-[(E)-furan-2-ylmethylideneamino]-2-[[2-(tritylamino)acetyl]amino]acetamide
CID 56691183
[(E)-furan-2-ylmethylideneamino]carbamic acid
CID 23219991
2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide
CID 7601999
N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide
CID 5101537
2-anilino-N-[(Z)-(2-methylphenyl)methylideneamino]acetamide
CID 7638625
2-anilino-N-[(E)-1H-pyrrol-2-ylmethylideneamino]acetamide
CID 135641150

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(furan-2-ylmethylideneamino)acetamide?
The IUPAC name of 2-anilino-N-(furan-2-ylmethylideneamino)acetamide (CID 3757182) is 2-anilino-N-(furan-2-ylmethylideneamino)acetamide.
What is the SMILES notation for 2-anilino-N-(furan-2-ylmethylideneamino)acetamide?
The canonical SMILES for 2-anilino-N-(furan-2-ylmethylideneamino)acetamide is O=C(CNc1ccccc1)NN=Cc1ccco1.
What is the InChIKey of 2-anilino-N-(furan-2-ylmethylideneamino)acetamide?
The InChIKey is QWULNYGKIRRUJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c17-13(10-14-11-5-2-1-3-6-11)16-15-9-12-7-4-8-18-12/h1-9,14H,10H2,(H,16,17).
What are the key properties of 2-anilino-N-(furan-2-ylmethylideneamino)acetamide?
2-anilino-N-(furan-2-ylmethylideneamino)acetamide has a molecular weight of 243.27 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-(furan-2-ylmethylideneamino)acetamide is sourced from PubChem (CID 3757182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).