2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide

C15H24N2O2 — CID 116845495

IUPAC2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide
SMILESCc1cc(C(C)(C)C)cc(C)c1COCC(=O)NN
InChIInChI=1S/C15H24N2O2/c1-10-6-12(15(3,4)5)7-11(2)13(10)8-19-9-14(18)17-16/h6-7H,8-9,16H2,1-5H3,(H,17,18)
InChIKeyRWXPGKJVTARRKC-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.11
Rot. Bonds4

About 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide

2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide (PubChem CID 116845495) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide.

Molecular Properties

Compound Name2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide
PubChem CID116845495
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide
SMILESCc1cc(C(C)(C)C)cc(C)c1COCC(=O)NN
InChIInChI=1S/C15H24N2O2/c1-10-6-12(15(3,4)5)7-11(2)13(10)8-19-9-14(18)17-16/h6-7H,8-9,16H2,1-5H3,(H,17,18)
InChIKeyRWXPGKJVTARRKC-UHFFFAOYSA-N
XLogP2.11
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.11
H-Bond Donors ≤ 52
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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Related Compounds

2-[(2-methoxy-3,4,6-trimethylphenyl)methoxy]acetohydrazide
CID 116845553
4-(4-tert-butyl-2,6-dimethylphenyl)butanehydrazide
CID 116843609
2-[(3-tert-butyl-4-methoxyphenyl)methoxy]acetohydrazide
CID 116845452
2-[(6-methyl-1,3-benzodioxol-5-yl)methoxy]acetohydrazide
CID 116845547
2-amino-3-(4-tert-butyl-2,6-dimethylphenyl)propanehydrazide
CID 116848629
benzene-1,3-diol;2-(2-hydrazinyl-2-oxoethoxy)acetohydrazide
CID 68738224
2-(2-bromo-4-tert-butyl-6-chlorophenoxy)acetohydrazide
CID 54793129
(4-tert-butyl-2,6-dimethylphenyl)methyl 2,4-dihydroxybenzoate
CID 5123968
(4-tert-butyl-2,6-dimethylphenyl)methyl 3-hydroxybenzoate
CID 23850196
(4-tert-butyl-2,6-dimethylphenyl)methyl 2-hydroxy-4-methylbenzoate
CID 4222789
(4-tert-butyl-2,6-dimethylphenyl)methyl 2,6-dimethoxybenzoate
CID 3500563
N'-[(4-tert-butyl-2,6-dimethylphenyl)methyl]oxamide
CID 115191842

Frequently Asked Questions

What is the IUPAC name of 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide?
The IUPAC name of 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide (CID 116845495) is 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide.
What is the SMILES notation for 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide?
The canonical SMILES for 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide is Cc1cc(C(C)(C)C)cc(C)c1COCC(=O)NN.
What is the InChIKey of 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide?
The InChIKey is RWXPGKJVTARRKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10-6-12(15(3,4)5)7-11(2)13(10)8-19-9-14(18)17-16/h6-7H,8-9,16H2,1-5H3,(H,17,18).
What are the key properties of 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide?
2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide has a molecular weight of 264.37 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-tert-butyl-2,6-dimethylphenyl)methoxy]acetohydrazide is sourced from PubChem (CID 116845495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).