N'-butyl-4-tert-butylbenzohydrazide

C15H24N2O — CID 117094788

IUPACN'-butyl-4-tert-butylbenzohydrazide
SMILESCCCCNNC(=O)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H24N2O/c1-5-6-11-16-17-14(18)12-7-9-13(10-8-12)15(2,3)4/h7-10,16H,5-6,11H2,1-4H3,(H,17,18)
InChIKeySKZFNTOJPSTVDI-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.02
Rot. Bonds5

About N'-butyl-4-tert-butylbenzohydrazide

N'-butyl-4-tert-butylbenzohydrazide (PubChem CID 117094788) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N'-butyl-4-tert-butylbenzohydrazide.

Molecular Properties

Compound NameN'-butyl-4-tert-butylbenzohydrazide
PubChem CID117094788
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN'-butyl-4-tert-butylbenzohydrazide
SMILESCCCCNNC(=O)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H24N2O/c1-5-6-11-16-17-14(18)12-7-9-13(10-8-12)15(2,3)4/h7-10,16H,5-6,11H2,1-4H3,(H,17,18)
InChIKeySKZFNTOJPSTVDI-UHFFFAOYSA-N
XLogP3.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-butyl-4-methylbenzohydrazide
CID 118418346
N'-butyl-3,4-dimethylbenzohydrazide
CID 162213335
4-tert-butyl-N-nonylbenzamide
CID 4642451
N'-undecylpyridine-4-carbohydrazide
CID 27387
1-N',6-N'-bis(4-tert-butylbenzoyl)hexanedihydrazide
CID 4209045
N'-butyl-3-fluorobenzohydrazide
CID 118418454
4-tert-butyl-N-[6-[(4-tert-butylbenzoyl)amino]hexyl]benzamide
CID 3415356
4-(3-methylheptylamino)-N'-propylbenzohydrazide
CID 166858690
4-tert-butyl-N-[4-[(octanoylamino)carbamoyl]phenyl]benzamide
CID 4958813
N-[[4-[(heptylamino)carbamoyl]phenyl]methyl]benzamide
CID 139558708
1-tert-butyl-4-methylbenzene;bis(4-tert-butyl-N-propylbenzamide)
CID 159281863
1-(4-tert-butylphenyl)dodecan-1-one
CID 146005513

Frequently Asked Questions

What is the IUPAC name of N'-butyl-4-tert-butylbenzohydrazide?
The IUPAC name of N'-butyl-4-tert-butylbenzohydrazide (CID 117094788) is N'-butyl-4-tert-butylbenzohydrazide.
What is the SMILES notation for N'-butyl-4-tert-butylbenzohydrazide?
The canonical SMILES for N'-butyl-4-tert-butylbenzohydrazide is CCCCNNC(=O)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of N'-butyl-4-tert-butylbenzohydrazide?
The InChIKey is SKZFNTOJPSTVDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-5-6-11-16-17-14(18)12-7-9-13(10-8-12)15(2,3)4/h7-10,16H,5-6,11H2,1-4H3,(H,17,18).
What are the key properties of N'-butyl-4-tert-butylbenzohydrazide?
N'-butyl-4-tert-butylbenzohydrazide has a molecular weight of 248.37 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-butyl-4-tert-butylbenzohydrazide is sourced from PubChem (CID 117094788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).