N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide

C14H12Cl2N2O — CID 127031947

IUPACN'-(2,6-dichlorophenyl)-4-methylbenzohydrazide
SMILESCc1ccc(C(=O)NNc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C14H12Cl2N2O/c1-9-5-7-10(8-6-9)14(19)18-17-13-11(15)3-2-4-12(13)16/h2-8,17H,1H3,(H,18,19)
InChIKeyRLTPYJDPPUEQHB-UHFFFAOYSA-N
MW295.17 g/mol
LogP4.06
Rot. Bonds3

About N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide

N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide (PubChem CID 127031947) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide.

Molecular Properties

Compound NameN'-(2,6-dichlorophenyl)-4-methylbenzohydrazide
PubChem CID127031947
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC NameN'-(2,6-dichlorophenyl)-4-methylbenzohydrazide
SMILESCc1ccc(C(=O)NNc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C14H12Cl2N2O/c1-9-5-7-10(8-6-9)14(19)18-17-13-11(15)3-2-4-12(13)16/h2-8,17H,1H3,(H,18,19)
InChIKeyRLTPYJDPPUEQHB-UHFFFAOYSA-N
XLogP4.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.17
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide?
The IUPAC name of N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide (CID 127031947) is N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide.
What is the SMILES notation for N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide?
The canonical SMILES for N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide is Cc1ccc(C(=O)NNc2c(Cl)cccc2Cl)cc1.
What is the InChIKey of N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide?
The InChIKey is RLTPYJDPPUEQHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c1-9-5-7-10(8-6-9)14(19)18-17-13-11(15)3-2-4-12(13)16/h2-8,17H,1H3,(H,18,19).
What are the key properties of N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide?
N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide has a molecular weight of 295.17 g/mol, XLogP of 4.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,6-dichlorophenyl)-4-methylbenzohydrazide is sourced from PubChem (CID 127031947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).