N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide

C16H18N2O2 — CID 174761410

IUPACN-(2,6-dimethylphenyl)-4-methoxybenzohydrazide
SMILESCOc1ccc(C(=O)N(N)c2c(C)cccc2C)cc1
InChIInChI=1S/C16H18N2O2/c1-11-5-4-6-12(2)15(11)18(17)16(19)13-7-9-14(20-3)10-8-13/h4-10H,17H2,1-3H3
InChIKeyFOLNUGNDMNMIIZ-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.83
Rot. Bonds3

About N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide

N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide (PubChem CID 174761410) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-4-methoxybenzohydrazide
PubChem CID174761410
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-(2,6-dimethylphenyl)-4-methoxybenzohydrazide
SMILESCOc1ccc(C(=O)N(N)c2c(C)cccc2C)cc1
InChIInChI=1S/C16H18N2O2/c1-11-5-4-6-12(2)15(11)18(17)16(19)13-7-9-14(20-3)10-8-13/h4-10H,17H2,1-3H3
InChIKeyFOLNUGNDMNMIIZ-UHFFFAOYSA-N
XLogP2.83
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'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-dimethylphenyl)-4-methoxybenzohydrazide?
The IUPAC name of N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide (CID 174761410) is N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide?
The canonical SMILES for N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide is COc1ccc(C(=O)N(N)c2c(C)cccc2C)cc1.
What is the InChIKey of N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide?
The InChIKey is FOLNUGNDMNMIIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-5-4-6-12(2)15(11)18(17)16(19)13-7-9-14(20-3)10-8-13/h4-10H,17H2,1-3H3.
What are the key properties of N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide?
N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide has a molecular weight of 270.33 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide is sourced from PubChem (CID 174761410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).