N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline

C17H17N4O2P — CID 4054616

IUPACN-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline
SMILESO=P(NN=Cc1ccco1)(Nc1ccccc1)Nc1ccccc1
InChIInChI=1S/C17H17N4O2P/c22-24(19-15-8-3-1-4-9-15,20-16-10-5-2-6-11-16)21-18-14-17-12-7-13-23-17/h1-14H,(H3,19,20,21,22)
InChIKeyZFKXONYPMYOGEL-UHFFFAOYSA-N
MW340.32 g/mol
LogP4.54
Rot. Bonds7

About N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline

N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline (PubChem CID 4054616) has the molecular formula C17H17N4O2P and a molecular weight of 340.32 g/mol. Its IUPAC name is N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline.

Molecular Properties

Compound NameN-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline
PubChem CID4054616
Molecular FormulaC17H17N4O2P
Molecular Weight340.32 g/mol
Exact Mass340.11
IUPAC NameN-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline
SMILESO=P(NN=Cc1ccco1)(Nc1ccccc1)Nc1ccccc1
InChIInChI=1S/C17H17N4O2P/c22-24(19-15-8-3-1-4-9-15,20-16-10-5-2-6-11-16)21-18-14-17-12-7-13-23-17/h1-14H,(H3,19,20,21,22)
InChIKeyZFKXONYPMYOGEL-UHFFFAOYSA-N
XLogP4.54
TPSA78.66 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.32
LogP ≤ 54.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline 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

[(E)-furan-2-ylmethylideneamino]carbamic acid
CID 23219991
2-anilino-N-(furan-2-ylmethylideneamino)acetamide
CID 3757182
anilino-[(2Z)-2-(furan-2-ylmethylidene)hydrazinyl]methanethiol
CID 52913666
N-[(Z)-furan-2-ylmethylideneamino]benzenesulfonamide
CID 6269707
bis(anilino-[(2Z)-2-(furan-2-ylmethylidene)hydrazinyl]methanethiolate);palladium(2+)
CID 52913665
N-[(Z)-furan-2-ylmethylideneamino]-2-methylbenzamide
CID 5411378
(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine
CID 46707076
5-bromo-N-(furan-2-ylmethylideneamino)-2-hydroxybenzamide
CID 767297
N-(furan-2-ylmethylideneamino)-5-(phenylcarbamoylamino)thiadiazole-4-carboxamide
CID 1499153
1-(furan-2-yl)-N-oxidomethanimine
CID 135527449
N-[(Z)-furan-2-ylmethylideneamino]-2-[[(E)-3-phenylprop-2-enoyl]amino]benzamide
CID 126003105
N-[(E)-furan-2-ylmethylideneamino]-2,5-dimethylfuran-3-carboxamide
CID 7727331

Frequently Asked Questions

What is the IUPAC name of N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline?
The IUPAC name of N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline (CID 4054616) is N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline.
What is the SMILES notation for N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline?
The canonical SMILES for N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline is O=P(NN=Cc1ccco1)(Nc1ccccc1)Nc1ccccc1.
What is the InChIKey of N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline?
The InChIKey is ZFKXONYPMYOGEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N4O2P/c22-24(19-15-8-3-1-4-9-15,20-16-10-5-2-6-11-16)21-18-14-17-12-7-13-23-17/h1-14H,(H3,19,20,21,22).
What are the key properties of N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline?
N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline has a molecular weight of 340.32 g/mol, XLogP of 4.54, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[anilino-[2-(furan-2-ylmethylidene)hydrazinyl]phosphoryl]aniline is sourced from PubChem (CID 4054616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).