3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide

C17H14Cl2N2O3 — CID 17133664

IUPAC3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide
SMILESC=CCOc1ccccc1C(=O)NNC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H14Cl2N2O3/c1-2-7-24-15-6-4-3-5-14(15)17(23)21-20-16(22)11-8-12(18)10-13(19)9-11/h2-6,8-10H,1,7H2,(H,20,22)(H,21,23)
InChIKeyABWBPCCKPJLIAJ-UHFFFAOYSA-N
MW365.22 g/mol
LogP3.63
Rot. Bonds5

About 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide

3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide (PubChem CID 17133664) has the molecular formula C17H14Cl2N2O3 and a molecular weight of 365.22 g/mol. Its IUPAC name is 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide.

Molecular Properties

Compound Name3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide
PubChem CID17133664
Molecular FormulaC17H14Cl2N2O3
Molecular Weight365.22 g/mol
Exact Mass364.04
IUPAC Name3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide
SMILESC=CCOc1ccccc1C(=O)NNC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H14Cl2N2O3/c1-2-7-24-15-6-4-3-5-14(15)17(23)21-20-16(22)11-8-12(18)10-13(19)9-11/h2-6,8-10H,1,7H2,(H,20,22)(H,21,23)
InChIKeyABWBPCCKPJLIAJ-UHFFFAOYSA-N
XLogP3.63
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.22
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3,5-dichloro-N'-(2-methoxybenzoyl)benzohydrazide
CID 17133653
N'-(4-tert-butylbenzoyl)-2-prop-2-enoxybenzohydrazide
CID 4929142
N'-(2-iodobenzoyl)-2-prop-2-enoxybenzohydrazide
CID 4929047
N'-[2-(2-chlorophenoxy)acetyl]-2-prop-2-enoxybenzohydrazide
CID 4929148
N'-(2-propan-2-yloxybenzoyl)-2-prop-2-enoxybenzohydrazide
CID 17045713
N'-(cyclopropanecarbonyl)-2-prop-2-enoxybenzohydrazide
CID 4929134
N'-[2-(2-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide
CID 4932333
N'-[2-(2-bromo-4-chlorophenoxy)propanoyl]-2-prop-2-enoxybenzohydrazide
CID 4981545
tert-butyl N-[(2-prop-2-enoxybenzoyl)amino]carbamate
CID 137320522
N'-hexanoyl-2-prop-2-enoxybenzohydrazide
CID 4953986
3-bromo-N'-(2-prop-2-enoxybenzoyl)-4-propoxybenzohydrazide
CID 17342922
N'-heptanoyl-2-prop-2-enoxybenzohydrazide
CID 54789258

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide?
The IUPAC name of 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide (CID 17133664) is 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide.
What is the SMILES notation for 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide?
The canonical SMILES for 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide is C=CCOc1ccccc1C(=O)NNC(=O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide?
The InChIKey is ABWBPCCKPJLIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2N2O3/c1-2-7-24-15-6-4-3-5-14(15)17(23)21-20-16(22)11-8-12(18)10-13(19)9-11/h2-6,8-10H,1,7H2,(H,20,22)(H,21,23).
What are the key properties of 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide?
3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide has a molecular weight of 365.22 g/mol, XLogP of 3.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N'-(2-prop-2-enoxybenzoyl)benzohydrazide is sourced from PubChem (CID 17133664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).