[(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol

C22H24N2O2 — CID 118858077

IUPAC[(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol
SMILESCOc1ccc2c(c1)CCC/C2=N\N=C1/CCCc2cc(CO)ccc21
InChIInChI=1S/C22H24N2O2/c1-26-18-9-11-20-17(13-18)5-3-7-22(20)24-23-21-6-2-4-16-12-15(14-25)8-10-19(16)21/h8-13,25H,2-7,14H2,1H3/b23-21+,24-22+
InChIKeyMGZDPSBIRJJLOJ-MBALSZOMSA-N
MW348.45 g/mol
LogP4.05
Rot. Bonds3

About [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol

[(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol (PubChem CID 118858077) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol.

Molecular Properties

Compound Name[(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol
PubChem CID118858077
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name[(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol
SMILESCOc1ccc2c(c1)CCC/C2=N\N=C1/CCCc2cc(CO)ccc21
InChIInChI=1S/C22H24N2O2/c1-26-18-9-11-20-17(13-18)5-3-7-22(20)24-23-21-6-2-4-16-12-15(14-25)8-10-19(16)21/h8-13,25H,2-7,14H2,1H3/b23-21+,24-22+
InChIKeyMGZDPSBIRJJLOJ-MBALSZOMSA-N
XLogP4.05
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.05
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 [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol?
The IUPAC name of [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol (CID 118858077) is [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol.
What is the SMILES notation for [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol?
The canonical SMILES for [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol is COc1ccc2c(c1)CCC/C2=N\N=C1/CCCc2cc(CO)ccc21.
What is the InChIKey of [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol?
The InChIKey is MGZDPSBIRJJLOJ-MBALSZOMSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-26-18-9-11-20-17(13-18)5-3-7-22(20)24-23-21-6-2-4-16-12-15(14-25)8-10-19(16)21/h8-13,25H,2-7,14H2,1H3/b23-21+,24-22+.
What are the key properties of [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol?
[(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol has a molecular weight of 348.45 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5E)-5-[(E)-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)hydrazinylidene]-7,8-dihydro-6H-naphthalen-2-yl]methanol is sourced from PubChem (CID 118858077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).