N-hydroxy-2,2-dimethylpentanamide;hydrochloride

C7H16ClNO2 — CID 140997012

IUPACN-hydroxy-2,2-dimethylpentanamide;hydrochloride
SMILESCCCC(C)(C)C(=O)NO.Cl
InChIInChI=1S/C7H15NO2.ClH/c1-4-5-7(2,3)6(9)8-10;/h10H,4-5H2,1-3H3,(H,8,9);1H
InChIKeyYLTLKQQARRMEKJ-UHFFFAOYSA-N
MW181.66 g/mol
LogP1.74
Rot. Bonds3

About N-hydroxy-2,2-dimethylpentanamide;hydrochloride

N-hydroxy-2,2-dimethylpentanamide;hydrochloride (PubChem CID 140997012) has the molecular formula C7H16ClNO2 and a molecular weight of 181.66 g/mol. Its IUPAC name is N-hydroxy-2,2-dimethylpentanamide;hydrochloride.

Molecular Properties

Compound NameN-hydroxy-2,2-dimethylpentanamide;hydrochloride
PubChem CID140997012
Molecular FormulaC7H16ClNO2
Molecular Weight181.66 g/mol
Exact Mass181.09
IUPAC NameN-hydroxy-2,2-dimethylpentanamide;hydrochloride
SMILESCCCC(C)(C)C(=O)NO.Cl
InChIInChI=1S/C7H15NO2.ClH/c1-4-5-7(2,3)6(9)8-10;/h10H,4-5H2,1-3H3,(H,8,9);1H
InChIKeyYLTLKQQARRMEKJ-UHFFFAOYSA-N
XLogP1.74
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.66
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-hydroxy-2,2-dimethylheptadecanamide
CID 138558717
N-hydroxy-2-methyl-2-methylsulfonylpentanamide
CID 155407178
N-(3-amino-3-oxopropyl)-2,2-dimethylpentanamide
CID 130272228
N-[2-(dimethylamino)-2-oxoethyl]-2,2-dimethylpentanamide
CID 130272126
2-hexyl-N-hydroxy-2-methyloctanamide
CID 170033401
N-hydroxy-2,2,4,4-tetramethyl-5-oxohexanamide
CID 89136777
N,2,2-trimethylhexanamide
CID 87705334
3,3,5,5-tetramethyloctan-4-one
CID 89362590
silver 2,2-dimethylpentanoate
CID 121375132
2-ethyl-N-hydroxy-2-methylpentadecanamide
CID 138558679
CID 20669389
CID 20669389
N,2,2-trimethyloctadecanamide
CID 158817445

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2,2-dimethylpentanamide;hydrochloride?
The IUPAC name of N-hydroxy-2,2-dimethylpentanamide;hydrochloride (CID 140997012) is N-hydroxy-2,2-dimethylpentanamide;hydrochloride.
What is the SMILES notation for N-hydroxy-2,2-dimethylpentanamide;hydrochloride?
The canonical SMILES for N-hydroxy-2,2-dimethylpentanamide;hydrochloride is CCCC(C)(C)C(=O)NO.Cl.
What is the InChIKey of N-hydroxy-2,2-dimethylpentanamide;hydrochloride?
The InChIKey is YLTLKQQARRMEKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2.ClH/c1-4-5-7(2,3)6(9)8-10;/h10H,4-5H2,1-3H3,(H,8,9);1H.
What are the key properties of N-hydroxy-2,2-dimethylpentanamide;hydrochloride?
N-hydroxy-2,2-dimethylpentanamide;hydrochloride has a molecular weight of 181.66 g/mol, XLogP of 1.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2,2-dimethylpentanamide;hydrochloride is sourced from PubChem (CID 140997012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).