N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide

C20H17N3O — CID 142481944

IUPACN-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide
SMILES[H]/N=C(\N=C(/N)c1ccccc1)c1ccc2oc3c(c2c1)=CCCC=3
InChIInChI=1S/C20H17N3O/c21-19(13-6-2-1-3-7-13)23-20(22)14-10-11-18-16(12-14)15-8-4-5-9-17(15)24-18/h1-3,6-12H,4-5H2,(H3,21,22,23)
InChIKeyMCAVLHJHJFHWJX-UHFFFAOYSA-N
MW315.38 g/mol
LogP2.52
Rot. Bonds2

About N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide

N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide (PubChem CID 142481944) has the molecular formula C20H17N3O and a molecular weight of 315.38 g/mol. Its IUPAC name is N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide.

Molecular Properties

Compound NameN-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide
PubChem CID142481944
Molecular FormulaC20H17N3O
Molecular Weight315.38 g/mol
Exact Mass315.14
IUPAC NameN-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide
SMILES[H]/N=C(\N=C(/N)c1ccccc1)c1ccc2oc3c(c2c1)=CCCC=3
InChIInChI=1S/C20H17N3O/c21-19(13-6-2-1-3-7-13)23-20(22)14-10-11-18-16(12-14)15-8-4-5-9-17(15)24-18/h1-3,6-12H,4-5H2,(H3,21,22,23)
InChIKeyMCAVLHJHJFHWJX-UHFFFAOYSA-N
XLogP2.52
TPSA75.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide 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'-(benzenecarboximidoyl)benzenecarboximidamide;7-methyl-2,3-dihydrodibenzothiophene
CID 145452295
N'-(benzenecarboximidoyl)-3-[8-[2-(2-phenylphenyl)phenyl]dibenzofuran-1-yl]benzenecarboximidamide
CID 145447845
N-[amino-(4-phenylphenyl)methylidene]dibenzofuran-2-carboximidamide;2-methyl-5-phenyl-9H-fluorene
CID 142615355
N-[amino-(3-phenylphenyl)methylidene]-3-phenyldibenzofuran-1-carboximidamide
CID 174023175
N'-(benzenecarboximidoyl)benzenecarboximidamide;1-bromo-3-methylbenzene
CID 142324241
N'-(benzenecarboximidoyl)benzenecarboximidamide;3-(9-methyldibenzofuran-2-yl)-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 142451988
4-fluoro-N'-(4-fluorobenzenecarboximidoyl)benzenecarboximidamide
CID 130271294
N-[amino(phenyl)methylidene]-10-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenanthrene-9-carboximidamide
CID 137302881
N-[amino(phenyl)methylidene]-9,9-dimethylfluorene-2-carboximidamide;1-(3-methylphenyl)-8-phenanthren-3-yldibenzofuran
CID 145447143
N'-(benzenecarboximidoyl)benzenecarboximidamide;5-(9-methyldibenzofuran-2-yl)-7-phenylindolo[2,3-b]carbazole
CID 170785636
N-[amino(phenyl)methylidene]-4-(2-cyanophenyl)benzenecarboximidamide
CID 142469905
dibenzofuran-2-yl(phenyl)methanimine
CID 167230325

Frequently Asked Questions

What is the IUPAC name of N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide?
The IUPAC name of N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide (CID 142481944) is N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide.
What is the SMILES notation for N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide?
The canonical SMILES for N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide is [H]/N=C(\N=C(/N)c1ccccc1)c1ccc2oc3c(c2c1)=CCCC=3.
What is the InChIKey of N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide?
The InChIKey is MCAVLHJHJFHWJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O/c21-19(13-6-2-1-3-7-13)23-20(22)14-10-11-18-16(12-14)15-8-4-5-9-17(15)24-18/h1-3,6-12H,4-5H2,(H3,21,22,23).
What are the key properties of N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide?
N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide has a molecular weight of 315.38 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[amino(phenyl)methylidene]-7,8-dihydrodibenzofuran-2-carboximidamide is sourced from PubChem (CID 142481944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).