4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide

C18H18N2O4 — CID 926990

IUPAC4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)/C=C/c2ccccc2OC)cc1
InChIInChI=1S/C18H18N2O4/c1-23-15-10-7-14(8-11-15)18(22)20-19-17(21)12-9-13-5-3-4-6-16(13)24-2/h3-12H,1-2H3,(H,19,21)(H,20,22)/b12-9+
InChIKeyKWRRGINGZFFILG-FMIVXFBMSA-N
MW326.35 g/mol
LogP2.18
Rot. Bonds5

About 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide

4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide (PubChem CID 926990) has the molecular formula C18H18N2O4 and a molecular weight of 326.35 g/mol. Its IUPAC name is 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide.

Molecular Properties

Compound Name4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide
PubChem CID926990
Molecular FormulaC18H18N2O4
Molecular Weight326.35 g/mol
Exact Mass326.13
IUPAC Name4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)/C=C/c2ccccc2OC)cc1
InChIInChI=1S/C18H18N2O4/c1-23-15-10-7-14(8-11-15)18(22)20-19-17(21)12-9-13-5-3-4-6-16(13)24-2/h3-12H,1-2H3,(H,19,21)(H,20,22)/b12-9+
InChIKeyKWRRGINGZFFILG-FMIVXFBMSA-N
XLogP2.18
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-[(E)-3-[2-(4-methoxybenzoyl)hydrazinyl]-3-oxoprop-1-enyl]phenyl] (E)-3-phenylprop-2-enoate
CID 126040700
N-[4-[[3-(2-methoxyphenyl)prop-2-enoylamino]carbamoyl]phenyl]propanamide
CID 5020772
N'-[3-(2,3-dimethoxyphenyl)prop-2-enoyl]benzohydrazide
CID 4789480
N'-[(E)-3-(2,5-dimethoxyphenyl)prop-2-enoyl]-4-methylbenzohydrazide
CID 2672384
3-(2-methoxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one
CID 3292811
4-ethoxy-N-[4-[[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]carbamoyl]phenyl]benzenesulfonamide
CID 55349799
N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide
CID 123173944
4-methoxy-N'-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]benzohydrazide
CID 7948325
(E)-3-(2-methoxyphenyl)-N-[[(4-prop-2-enoxybenzoyl)amino]carbamothioyl]prop-2-enamide
CID 6232565
N'-[(E)-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl]-3,4-dimethoxybenzohydrazide
CID 26025403
3-(2-methoxyphenyl)-N-[[(4-phenylbenzoyl)amino]carbamothioyl]prop-2-enamide
CID 4273508
N'-[(E)-3-(furan-2-yl)prop-2-enoyl]-4-methoxybenzohydrazide
CID 922444

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide?
The IUPAC name of 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide (CID 926990) is 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide.
What is the SMILES notation for 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide?
The canonical SMILES for 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide is COc1ccc(C(=O)NNC(=O)/C=C/c2ccccc2OC)cc1.
What is the InChIKey of 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide?
The InChIKey is KWRRGINGZFFILG-FMIVXFBMSA-N. The full InChI is InChI=1S/C18H18N2O4/c1-23-15-10-7-14(8-11-15)18(22)20-19-17(21)12-9-13-5-3-4-6-16(13)24-2/h3-12H,1-2H3,(H,19,21)(H,20,22)/b12-9+.
What are the key properties of 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide?
4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide has a molecular weight of 326.35 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]benzohydrazide is sourced from PubChem (CID 926990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).