N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide

C16H19N3O2 — CID 5338367

IUPACN-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide
SMILESCCN(CC)c1ccc(/C=N/NC(=O)c2ccco2)cc1
InChIInChI=1S/C16H19N3O2/c1-3-19(4-2)14-9-7-13(8-10-14)12-17-18-16(20)15-6-5-11-21-15/h5-12H,3-4H2,1-2H3,(H,18,20)/b17-12+
InChIKeyNUFJVJRIKWMAHU-SFQUDFHCSA-N
MW285.35 g/mol
LogP2.89
Rot. Bonds6

About N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide

N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide (PubChem CID 5338367) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide
PubChem CID5338367
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide
SMILESCCN(CC)c1ccc(/C=N/NC(=O)c2ccco2)cc1
InChIInChI=1S/C16H19N3O2/c1-3-19(4-2)14-9-7-13(8-10-14)12-17-18-16(20)15-6-5-11-21-15/h5-12H,3-4H2,1-2H3,(H,18,20)/b17-12+
InChIKeyNUFJVJRIKWMAHU-SFQUDFHCSA-N
XLogP2.89
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.89
H-Bond Donors ≤ 51
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'}

Analyze N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-[(E)-phenylmethylidene]furan-2-carbohydrazide
CID 6869164
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-methylfuran-3-carboxamide
CID 5342258
N'-{3-[4-(dimethylamino)phenyl]-2-propenylidene}-2-methyl-3-furohydrazide
CID 9607499
1-(furan-2-carbonyl)-N-(4-methylphenyl)piperidine-4-carboxamide
CID 6463949
Antiviral ST-161
CID 9702096
N-[4-[(E)-C-methyl-N-[[(1S,2R)-2-phenylcyclopropanecarbonyl]amino]carbonimidoyl]phenyl]furan-2-carboxamide
CID 9702097
N-[4-[(E)-C-methyl-N-[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbonimidoyl]phenyl]furan-2-carboxamide
CID 9702099
2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-(4-methylphenyl)acetamide
CID 795870
N-(2-{(2E)-2-[4-(dimethylamino)benzylidene]hydrazino}-2-oxoethyl)-2-furamide
CID 5333609
N-[(E)-(4-methylphenyl)methylideneamino]furan-2-carboxamide
CID 6870919
3-(dimethylamino)-N'-(3-furylmethylene)benzohydrazide
CID 6875111
N-{3-[N-(2-furoyl)ethanehydrazonoyl]phenyl}-5-methyl-2-furamide
CID 5431302

Frequently Asked Questions

What is the IUPAC name of N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide?
The IUPAC name of N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide (CID 5338367) is N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide.
What is the SMILES notation for N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide?
The canonical SMILES for N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide is CCN(CC)c1ccc(/C=N/NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide?
The InChIKey is NUFJVJRIKWMAHU-SFQUDFHCSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-3-19(4-2)14-9-7-13(8-10-14)12-17-18-16(20)15-6-5-11-21-15/h5-12H,3-4H2,1-2H3,(H,18,20)/b17-12+.
What are the key properties of N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide?
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[4-(diethylamino)phenyl]methylideneamino]furan-2-carboxamide is sourced from PubChem (CID 5338367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).