N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide

C18H18F2N2O4 — CID 2435971

IUPACN'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide
SMILESC=C(NNC(=O)c1ccc(OC)c(OC)c1)c1ccc(OC(F)F)cc1
InChIInChI=1S/C18H18F2N2O4/c1-11(12-4-7-14(8-5-12)26-18(19)20)21-22-17(23)13-6-9-15(24-2)16(10-13)25-3/h4-10,18,21H,1H2,2-3H3,(H,22,23)
InChIKeyACIJCRDTZWSGIU-UHFFFAOYSA-N
MW364.35 g/mol
LogP3.21
Rot. Bonds8

About N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide

N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide (PubChem CID 2435971) has the molecular formula C18H18F2N2O4 and a molecular weight of 364.35 g/mol. Its IUPAC name is N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide.

Molecular Properties

Compound NameN'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide
PubChem CID2435971
Molecular FormulaC18H18F2N2O4
Molecular Weight364.35 g/mol
Exact Mass364.12
IUPAC NameN'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide
SMILESC=C(NNC(=O)c1ccc(OC)c(OC)c1)c1ccc(OC(F)F)cc1
InChIInChI=1S/C18H18F2N2O4/c1-11(12-4-7-14(8-5-12)26-18(19)20)21-22-17(23)13-6-9-15(24-2)16(10-13)25-3/h4-10,18,21H,1H2,2-3H3,(H,22,23)
InChIKeyACIJCRDTZWSGIU-UHFFFAOYSA-N
XLogP3.21
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.35
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-[4-(difluoromethoxy)benzoyl]-3-methoxy-4-propan-2-yloxybenzohydrazide
CID 26655758
N'-[1-(4-cyanophenyl)ethenyl]-3,4-dimethoxybenzohydrazide
CID 2453941
4-chloro-N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]benzohydrazide
CID 2340459
N'-[2-(4-cyanophenoxy)acetyl]-4-(difluoromethoxy)-3-methoxybenzohydrazide
CID 7978485
N'-[2-(4-acetylphenoxy)propanoyl]-3,4-dimethoxybenzohydrazide
CID 24554535
1-[[4-(difluoromethoxy)-3-methoxybenzoyl]amino]-3-(4-methoxyphenyl)thiourea
CID 1000420
methyl 4-[[4-(difluoromethoxy)phenyl]methoxy]-3-methoxybenzoate
CID 60558779
1-[[4-(difluoromethoxy)-3-methoxybenzoyl]amino]-3-propan-2-ylthiourea
CID 7978091
4-(difluoromethoxy)-N-(2-hydroxyethyl)-3-methoxybenzamide
CID 78783270
N'-(3,5-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
CID 24645355
[2-(3,4-dimethoxyphenyl)-2-oxoethyl] 4-(difluoromethoxy)benzoate
CID 2612428
2-[4-(difluoromethoxy)phenyl]-N-[(3,4-dimethoxyphenyl)methyl]acetamide
CID 51200356

Frequently Asked Questions

What is the IUPAC name of N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide?
The IUPAC name of N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide (CID 2435971) is N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide.
What is the SMILES notation for N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide?
The canonical SMILES for N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide is C=C(NNC(=O)c1ccc(OC)c(OC)c1)c1ccc(OC(F)F)cc1.
What is the InChIKey of N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide?
The InChIKey is ACIJCRDTZWSGIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O4/c1-11(12-4-7-14(8-5-12)26-18(19)20)21-22-17(23)13-6-9-15(24-2)16(10-13)25-3/h4-10,18,21H,1H2,2-3H3,(H,22,23).
What are the key properties of N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide?
N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide has a molecular weight of 364.35 g/mol, XLogP of 3.21, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-[4-(difluoromethoxy)phenyl]ethenyl]-3,4-dimethoxybenzohydrazide is sourced from PubChem (CID 2435971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).