N'-benzyl-4,4-dimethylpentanehydrazide

C14H22N2O — CID 22069131

IUPACN'-benzyl-4,4-dimethylpentanehydrazide
SMILESCC(C)(C)CCC(=O)NNCc1ccccc1
InChIInChI=1S/C14H22N2O/c1-14(2,3)10-9-13(17)16-15-11-12-7-5-4-6-8-12/h4-8,15H,9-11H2,1-3H3,(H,16,17)
InChIKeyRCKKHBBAZFWSMC-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.63
Rot. Bonds5

About N'-benzyl-4,4-dimethylpentanehydrazide

N'-benzyl-4,4-dimethylpentanehydrazide (PubChem CID 22069131) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N'-benzyl-4,4-dimethylpentanehydrazide.

Molecular Properties

Compound NameN'-benzyl-4,4-dimethylpentanehydrazide
PubChem CID22069131
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN'-benzyl-4,4-dimethylpentanehydrazide
SMILESCC(C)(C)CCC(=O)NNCc1ccccc1
InChIInChI=1S/C14H22N2O/c1-14(2,3)10-9-13(17)16-15-11-12-7-5-4-6-8-12/h4-8,15H,9-11H2,1-3H3,(H,16,17)
InChIKeyRCKKHBBAZFWSMC-UHFFFAOYSA-N
XLogP2.63
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.63
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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Related Compounds

N-benzyl-4,4-dimethylpentanamide
CID 59836653
N'-benzylhexadecanehydrazide
CID 154391297
(2R)-N'-benzyl-2,4-dihydroxy-3,3-dimethylbutanehydrazide
CID 3048066
N'-benzyl-2-methylprop-2-enehydrazide
CID 175049559
5,5-dimethyl-1-phenylmethoxyhexan-2-one
CID 131052640
7,7-dimethyl-1-phenyloctan-4-one
CID 105093400
tert-butyl N-(2-benzylhydrazinyl)carbamate
CID 69172873
benzyl N-(5,5-dimethyl-2-oxohexyl)carbamate
CID 165468544
N-benzyl-3-[ditert-butyl(fluoro)silyl]propanamide
CID 72704095
1-benzyl-3-[1-(2-benzylhydrazinyl)-3,3-dimethyl-1-oxobutan-2-yl]urea
CID 72991474
N-(2-amino-2-phenylethyl)-4,4-dimethylpentanamide
CID 119529676
N-(3,3-dimethylbutyl)-2-phenylmethoxyacetamide
CID 58756722

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-4,4-dimethylpentanehydrazide?
The IUPAC name of N'-benzyl-4,4-dimethylpentanehydrazide (CID 22069131) is N'-benzyl-4,4-dimethylpentanehydrazide.
What is the SMILES notation for N'-benzyl-4,4-dimethylpentanehydrazide?
The canonical SMILES for N'-benzyl-4,4-dimethylpentanehydrazide is CC(C)(C)CCC(=O)NNCc1ccccc1.
What is the InChIKey of N'-benzyl-4,4-dimethylpentanehydrazide?
The InChIKey is RCKKHBBAZFWSMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-14(2,3)10-9-13(17)16-15-11-12-7-5-4-6-8-12/h4-8,15H,9-11H2,1-3H3,(H,16,17).
What are the key properties of N'-benzyl-4,4-dimethylpentanehydrazide?
N'-benzyl-4,4-dimethylpentanehydrazide has a molecular weight of 234.34 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-4,4-dimethylpentanehydrazide is sourced from PubChem (CID 22069131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).