2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide

C17H16Cl2N2O3 — CID 4952081

IUPAC2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide
SMILESCC(C)Oc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C17H16Cl2N2O3/c1-10(2)24-13-6-3-11(4-7-13)16(22)20-21-17(23)14-8-5-12(18)9-15(14)19/h3-10H,1-2H3,(H,20,22)(H,21,23)
InChIKeyCOJADMOOGOMJDG-UHFFFAOYSA-N
MW367.23 g/mol
LogP3.86
Rot. Bonds4

About 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide

2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide (PubChem CID 4952081) has the molecular formula C17H16Cl2N2O3 and a molecular weight of 367.23 g/mol. Its IUPAC name is 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide.

Molecular Properties

Compound Name2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide
PubChem CID4952081
Molecular FormulaC17H16Cl2N2O3
Molecular Weight367.23 g/mol
Exact Mass366.05
IUPAC Name2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide
SMILESCC(C)Oc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C17H16Cl2N2O3/c1-10(2)24-13-6-3-11(4-7-13)16(22)20-21-17(23)14-8-5-12(18)9-15(14)19/h3-10H,1-2H3,(H,20,22)(H,21,23)
InChIKeyCOJADMOOGOMJDG-UHFFFAOYSA-N
XLogP3.86
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.23
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2,4-dichlorophenoxy)acetyl]-4-propan-2-yloxybenzohydrazide
CID 4952085
2,4-dichloro-N'-[4-(trifluoromethoxy)benzoyl]benzohydrazide
CID 2744744
2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154669
N-[(2,4-dichlorophenyl)carbamothioyl]-4-propan-2-yloxybenzamide
CID 1339065
N'-(4-fluorobenzoyl)-4-propan-2-yloxybenzohydrazide
CID 40606275
N-(4-butan-2-yloxyphenyl)-2,4-dichlorobenzamide
CID 17160527
2,4-dichloro-N-[4-[[4-(2-methylpropoxy)benzoyl]amino]phenyl]benzamide
CID 2263896
2,4-dichloro-N'-(4-nitrobenzoyl)benzohydrazide
CID 3591876
N-(3-chlorophenyl)-4-propan-2-yloxybenzamide
CID 823397
1-N',4-N'-bis[2-(2,4-dichlorophenoxy)propanoyl]benzene-1,4-dicarbohydrazide
CID 3359373
N'-(4-propan-2-yloxybenzoyl)pyridine-4-carbohydrazide
CID 959964
N'-[(2S)-2-(2,4-dichlorophenoxy)propanoyl]-4-methoxybenzohydrazide
CID 1104980

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide?
The IUPAC name of 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide (CID 4952081) is 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide.
What is the SMILES notation for 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide?
The canonical SMILES for 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide is CC(C)Oc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1.
What is the InChIKey of 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide?
The InChIKey is COJADMOOGOMJDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O3/c1-10(2)24-13-6-3-11(4-7-13)16(22)20-21-17(23)14-8-5-12(18)9-15(14)19/h3-10H,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide?
2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide has a molecular weight of 367.23 g/mol, XLogP of 3.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide is sourced from PubChem (CID 4952081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).