N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide

C22H20N2O3 — CID 26619016

IUPACN'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide
SMILESCOc1ccc(C(=O)NNC2c3ccccc3-c3ccccc32)cc1OC
InChIInChI=1S/C22H20N2O3/c1-26-19-12-11-14(13-20(19)27-2)22(25)24-23-21-17-9-5-3-7-15(17)16-8-4-6-10-18(16)21/h3-13,21,23H,1-2H3,(H,24,25)
InChIKeyHXTKYFZLHURSFT-UHFFFAOYSA-N
MW360.41 g/mol
LogP3.71
Rot. Bonds5

About N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide

N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide (PubChem CID 26619016) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide.

Molecular Properties

Compound NameN'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide
PubChem CID26619016
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC NameN'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide
SMILESCOc1ccc(C(=O)NNC2c3ccccc3-c3ccccc32)cc1OC
InChIInChI=1S/C22H20N2O3/c1-26-19-12-11-14(13-20(19)27-2)22(25)24-23-21-17-9-5-3-7-15(17)16-8-4-6-10-18(16)21/h3-13,21,23H,1-2H3,(H,24,25)
InChIKeyHXTKYFZLHURSFT-UHFFFAOYSA-N
XLogP3.71
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide
CID 1210380
3,4-dimethoxy-N-sulfanylbenzamide
CID 71771275
2,6-dichloro-N'-(3,4-dimethoxybenzoyl)benzohydrazide
CID 78770574
methyl 3-[[(3,4-dimethoxybenzoyl)amino]carbamoyl]benzoate
CID 17175462
N-(1,3-dioxoisoindol-2-yl)-3,4-dimethoxybenzamide
CID 4923492
3,4-dimethoxy-N'-(3-phenylpropanoyl)benzohydrazide
CID 1107941
N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide
CID 34977030
N'-(3H-inden-1-yl)-3,4-dimethoxybenzohydrazide
CID 2387636
3,4-dimethoxy-N'-[2-(2-methoxyphenyl)acetyl]benzohydrazide
CID 24645288
3,4-dimethoxy-N'-(2-phenylsulfanylacetyl)benzohydrazide
CID 3283240
N'-(3,5-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
CID 24645355
N'-(2,2-dimethylpropanoyl)-3,4-dimethoxybenzohydrazide
CID 873947

Frequently Asked Questions

What is the IUPAC name of N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide?
The IUPAC name of N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide (CID 26619016) is N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide.
What is the SMILES notation for N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide?
The canonical SMILES for N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide is COc1ccc(C(=O)NNC2c3ccccc3-c3ccccc32)cc1OC.
What is the InChIKey of N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide?
The InChIKey is HXTKYFZLHURSFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-26-19-12-11-14(13-20(19)27-2)22(25)24-23-21-17-9-5-3-7-15(17)16-8-4-6-10-18(16)21/h3-13,21,23H,1-2H3,(H,24,25).
What are the key properties of N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide?
N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide has a molecular weight of 360.41 g/mol, XLogP of 3.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide is sourced from PubChem (CID 26619016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).