2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide

C12H8Cl3N3O — CID 134102994

IUPAC2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide
SMILESO=C(NNc1ccc(Cl)cn1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H8Cl3N3O/c13-7-4-5-10(16-6-7)17-18-12(19)11-8(14)2-1-3-9(11)15/h1-6H,(H,16,17)(H,18,19)
InChIKeyRFUBNSMEUKTNQC-UHFFFAOYSA-N
MW316.58 g/mol
LogP3.80
Rot. Bonds3

About 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide

2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide (PubChem CID 134102994) has the molecular formula C12H8Cl3N3O and a molecular weight of 316.58 g/mol. Its IUPAC name is 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide.

Molecular Properties

Compound Name2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide
PubChem CID134102994
Molecular FormulaC12H8Cl3N3O
Molecular Weight316.58 g/mol
Exact Mass314.97
IUPAC Name2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide
SMILESO=C(NNc1ccc(Cl)cn1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H8Cl3N3O/c13-7-4-5-10(16-6-7)17-18-12(19)11-8(14)2-1-3-9(11)15/h1-6H,(H,16,17)(H,18,19)
InChIKeyRFUBNSMEUKTNQC-UHFFFAOYSA-N
XLogP3.80
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.58
LogP ≤ 53.80
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

2,6-dichloro-N-[(5-chloro-2-pyridinyl)carbamoyl]benzamide
CID 23345083
2-N,6-N-bis(5-chloro-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 3421113
2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide
CID 23440185
2,6-dichloro-N'-(2-chlorobenzoyl)benzohydrazide
CID 78774908
4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055
2-chloro-N-[(5-chloro-2-pyridinyl)carbamothioyl]benzamide
CID 881777
2-amino-5-bromo-N'-(2,6-dichlorobenzoyl)pyridine-3-carbohydrazide
CID 118110158
N-(5-chloro-2-pyridinyl)-2-(2,3-dichloroanilino)acetamide
CID 78821308
2,6-dichloro-N-[(5-chloropyrazin-2-yl)carbamoyl]benzamide
CID 21313073
2,6-dichloro-N'-(5-chloro-2-methoxybenzoyl)benzohydrazide
CID 78775260
2,6-dichloro-N'-(4-ethoxyphenyl)benzohydrazide
CID 127031364
2-[(5-chloro-2-pyridinyl)amino]-2-oxoacetyl chloride
CID 152602540

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide?
The IUPAC name of 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide (CID 134102994) is 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide.
What is the SMILES notation for 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide?
The canonical SMILES for 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide is O=C(NNc1ccc(Cl)cn1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide?
The InChIKey is RFUBNSMEUKTNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl3N3O/c13-7-4-5-10(16-6-7)17-18-12(19)11-8(14)2-1-3-9(11)15/h1-6H,(H,16,17)(H,18,19).
What are the key properties of 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide?
2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide has a molecular weight of 316.58 g/mol, XLogP of 3.80, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N'-(5-chloro-2-pyridinyl)benzohydrazide is sourced from PubChem (CID 134102994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).