N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide

C17H26N2O3 — CID 134533395

IUPACN-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide
SMILESCC(C)(C)CC(C)(C)C(=O)Nc1ccc(CC(=O)NO)cc1
InChIInChI=1S/C17H26N2O3/c1-16(2,3)11-17(4,5)15(21)18-13-8-6-12(7-9-13)10-14(20)19-22/h6-9,22H,10-11H2,1-5H3,(H,18,21)(H,19,20)
InChIKeyWRBQNBVEAJGCJG-UHFFFAOYSA-N
MW306.41 g/mol
LogP3.14
Rot. Bonds5

About N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide

N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide (PubChem CID 134533395) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide.

Molecular Properties

Compound NameN-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide
PubChem CID134533395
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC NameN-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide
SMILESCC(C)(C)CC(C)(C)C(=O)Nc1ccc(CC(=O)NO)cc1
InChIInChI=1S/C17H26N2O3/c1-16(2,3)11-17(4,5)15(21)18-13-8-6-12(7-9-13)10-14(20)19-22/h6-9,22H,10-11H2,1-5H3,(H,18,21)(H,19,20)
InChIKeyWRBQNBVEAJGCJG-UHFFFAOYSA-N
XLogP3.14
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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-(4-acetylphenyl)-2,2,4,4-tetramethylpentanamide
CID 143619432
ethane;ethyl-dimethyl-[4-(2,2,4,4-tetramethylpentanoylamino)phenyl]azanium
CID 143837735
1,1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-hexadecamethyl-1-N,3-N,5-N,7-N,9-N,11-N,13-N,15-N,17-N,19-N,21-N,23-N,25-N,27-N,29-N-pentadecakis-phenyltriacontane-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-pentadecacarboxamide
CID 88975553
N-[4-[[4-[[4-(2,2-dimethylpropanoylamino)anilino]methyl]phenyl]methylamino]phenyl]-2,2-dimethylpropanamide
CID 155301754
methyl N-[4-[4-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]butyl]phenyl]carbamate
CID 73426367
1-N,3-N,5-N,7-N-tetrakis(4-hydroxyphenyl)-1,1,3,5,7-pentamethylnonane-1,3,5,7-tetracarboxamide
CID 134463643
N-hydroxy-2-[4-[4-[4-[(2-hydroxyacetyl)amino]phenyl]butyl]phenyl]acetamide
CID 73425834
2-[4-[(2-methoxy-2-methylpropanoyl)amino]phenyl]acetic acid
CID 113424569
3-chloro-2,2-dimethyl-N-[4-(propanoylamino)phenyl]propanamide
CID 63680174
2-[[2-[4-[[2-(3,3-dimethylbutanoylamino)acetyl]amino]phenyl]acetyl]amino]acetic acid
CID 119224549
N-(4-chlorophenyl)-2,2-dimethylbutanamide
CID 842553
2,2-dimethyl-N-[4-(sulfanylmethyl)phenyl]propanamide
CID 176900093

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide?
The IUPAC name of N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide (CID 134533395) is N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide.
What is the SMILES notation for N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide?
The canonical SMILES for N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide is CC(C)(C)CC(C)(C)C(=O)Nc1ccc(CC(=O)NO)cc1.
What is the InChIKey of N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide?
The InChIKey is WRBQNBVEAJGCJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-16(2,3)11-17(4,5)15(21)18-13-8-6-12(7-9-13)10-14(20)19-22/h6-9,22H,10-11H2,1-5H3,(H,18,21)(H,19,20).
What are the key properties of N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide?
N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide has a molecular weight of 306.41 g/mol, XLogP of 3.14, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]-2,2,4,4-tetramethylpentanamide is sourced from PubChem (CID 134533395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).