N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide

C16H19N3O — CID 62247328

IUPACN-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide
SMILESCc1cc(C)cc(N(C)C(=O)c2ccc(NN)cc2)c1
InChIInChI=1S/C16H19N3O/c1-11-8-12(2)10-15(9-11)19(3)16(20)13-4-6-14(18-17)7-5-13/h4-10,18H,17H2,1-3H3
InChIKeyBKBUGODPYYEAJZ-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.87
Rot. Bonds3

About N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide

N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide (PubChem CID 62247328) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide
PubChem CID62247328
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide
SMILESCc1cc(C)cc(N(C)C(=O)c2ccc(NN)cc2)c1
InChIInChI=1S/C16H19N3O/c1-11-8-12(2)10-15(9-11)19(3)16(20)13-4-6-14(18-17)7-5-13/h4-10,18H,17H2,1-3H3
InChIKeyBKBUGODPYYEAJZ-UHFFFAOYSA-N
XLogP2.87
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3,5-dimethylphenyl)-2-hydrazinyl-N,5-dimethylbenzamide
CID 62512821
3-amino-N-(3,5-dimethylphenyl)-4-fluoro-N-methylbenzamide
CID 62001591
N-methyl-4-(methylamino)-N-(3-methylphenyl)benzamide
CID 62175593
3-(4-aminophenyl)-1-(3,5-dimethylphenyl)-1-methylurea
CID 62003994
N-(3,5-dimethylphenyl)-6-fluoro-N-methylpyridine-3-carboxamide
CID 63979948
N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzenesulfonamide
CID 62002863
N-(3-aminophenyl)-N,4-dimethylbenzamide
CID 61296197
3-bromo-N-(3,5-dimethylphenyl)-N-methylbenzamide
CID 47314027
N-(3,5-dimethylphenyl)-N-methyl-5-(methylamino)pyridine-2-carboxamide
CID 104640795
N-(3,5-dimethylphenyl)-2-hydrazinyl-N-methyl-2-oxoacetamide
CID 62003274
N-(2-fluorophenyl)-4-hydrazinyl-N-methylbenzamide
CID 62249119
4-(benzenesulfonylmethyl)-N-(3,5-dimethylphenyl)-N-methylbenzamide
CID 55916827

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide?
The IUPAC name of N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide (CID 62247328) is N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide is Cc1cc(C)cc(N(C)C(=O)c2ccc(NN)cc2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide?
The InChIKey is BKBUGODPYYEAJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-11-8-12(2)10-15(9-11)19(3)16(20)13-4-6-14(18-17)7-5-13/h4-10,18H,17H2,1-3H3.
What are the key properties of N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide?
N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide has a molecular weight of 269.35 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-4-hydrazinyl-N-methylbenzamide is sourced from PubChem (CID 62247328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).