2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide

C22H21N3O3 — CID 2457579

IUPAC2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide
SMILESC=C(NNC(=O)c1ccccc1OCCOc1ccccc1)c1ccccn1
InChIInChI=1S/C22H21N3O3/c1-17(20-12-7-8-14-23-20)24-25-22(26)19-11-5-6-13-21(19)28-16-15-27-18-9-3-2-4-10-18/h2-14,24H,1,15-16H2,(H,25,26)
InChIKeyLBZROUVSLFTMSJ-UHFFFAOYSA-N
MW375.43 g/mol
LogP3.44
Rot. Bonds9

About 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide

2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide (PubChem CID 2457579) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide.

Molecular Properties

Compound Name2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide
PubChem CID2457579
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC Name2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide
SMILESC=C(NNC(=O)c1ccccc1OCCOc1ccccc1)c1ccccn1
InChIInChI=1S/C22H21N3O3/c1-17(20-12-7-8-14-23-20)24-25-22(26)19-11-5-6-13-21(19)28-16-15-27-18-9-3-2-4-10-18/h2-14,24H,1,15-16H2,(H,25,26)
InChIKeyLBZROUVSLFTMSJ-UHFFFAOYSA-N
XLogP3.44
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-N'-[2-(2-phenoxyethoxy)benzoyl]benzohydrazide
CID 4954440
N'-(2-ethoxyacetyl)-2-(2-phenoxyethoxy)benzohydrazide
CID 17140922
N'-hexanoyl-2-(2-phenoxyethoxy)benzohydrazide
CID 4955613
2-methoxy-N'-[4-(2-phenoxyethoxy)benzoyl]benzohydrazide
CID 4952919
N-methyl-2-[[2-(2-phenoxyethoxy)benzoyl]amino]benzamide
CID 17354042
1-(4-methylphenyl)-3-[[2-(2-phenoxyethoxy)benzoyl]amino]thiourea
CID 8619023
2-propoxy-N'-(2-propoxybenzoyl)benzohydrazide
CID 4948435
2-methyl-N-[4-[[[2-(2-phenoxyethoxy)benzoyl]amino]carbamoyl]phenyl]propanamide
CID 4954512
3-methyl-N'-[2-(2-phenoxyethoxy)benzoyl]-1-benzofuran-2-carbohydrazide
CID 27685461
N'-(2-hydroxy-3-methoxybenzoyl)pyridine-2-carbohydrazide
CID 69094543
N'-[2-(1-bromonaphthalen-2-yl)oxyacetyl]-2-(2-phenoxyethoxy)benzohydrazide
CID 4954463
N'-[4-(2-methoxyethoxy)benzoyl]-2-phenylmethoxybenzohydrazide
CID 17353669

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide?
The IUPAC name of 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide (CID 2457579) is 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide.
What is the SMILES notation for 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide?
The canonical SMILES for 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide is C=C(NNC(=O)c1ccccc1OCCOc1ccccc1)c1ccccn1.
What is the InChIKey of 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide?
The InChIKey is LBZROUVSLFTMSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-17(20-12-7-8-14-23-20)24-25-22(26)19-11-5-6-13-21(19)28-16-15-27-18-9-3-2-4-10-18/h2-14,24H,1,15-16H2,(H,25,26).
What are the key properties of 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide?
2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide has a molecular weight of 375.43 g/mol, XLogP of 3.44, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxyethoxy)-N'-(1-pyridin-2-ylethenyl)benzohydrazide is sourced from PubChem (CID 2457579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).