N-hydroxy-4-(4-methylpentyl)benzamide

C13H19NO2 — CID 59854516

IUPACN-hydroxy-4-(4-methylpentyl)benzamide
SMILESCC(C)CCCc1ccc(C(=O)NO)cc1
InChIInChI=1S/C13H19NO2/c1-10(2)4-3-5-11-6-8-12(9-7-11)13(15)14-16/h6-10,16H,3-5H2,1-2H3,(H,14,15)
InChIKeyUNMFSBYWNMJSIC-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.78
Rot. Bonds5

About N-hydroxy-4-(4-methylpentyl)benzamide

N-hydroxy-4-(4-methylpentyl)benzamide (PubChem CID 59854516) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-hydroxy-4-(4-methylpentyl)benzamide.

Molecular Properties

Compound NameN-hydroxy-4-(4-methylpentyl)benzamide
PubChem CID59854516
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-hydroxy-4-(4-methylpentyl)benzamide
SMILESCC(C)CCCc1ccc(C(=O)NO)cc1
InChIInChI=1S/C13H19NO2/c1-10(2)4-3-5-11-6-8-12(9-7-11)13(15)14-16/h6-10,16H,3-5H2,1-2H3,(H,14,15)
InChIKeyUNMFSBYWNMJSIC-UHFFFAOYSA-N
XLogP2.78
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.78
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

4-(6-methylheptyl)benzoic acid
CID 70349425
ethane;4-ethyl-N-hydroxybenzamide
CID 142831550
4-[[2,6-dimethyl-4-(3-methylbutyl)piperazin-1-yl]methyl]-N-hydroxybenzamide
CID 135269492
3-[[4-[7-[4-(4-methylpentoxy)phenoxy]heptyl]benzoyl]amino]propanoic acid
CID 67485973
4-[4-(4-methylpentyl)phenyl]butan-1-amine
CID 143596731
1,4-bis(8-methylnonyl)benzene;phosphorous acid
CID 175244550
4-(4-methylpentyl)phenol;phenol
CID 174866001
N'-hydroxy-4-(4-phenylbutyl)benzohydrazide
CID 89470701
[4-[(4R)-4,8-dimethylnonyl]phenyl]-(3-hydroxyphenyl)methanone
CID 11850230
N'-hydroxy-4-propylbenzohydrazide
CID 18359035
N-(6-methylheptan-2-yl)-4-sulfanylbenzamide
CID 107025136
N-[(2S)-3-acetamido-1-(3-methylbutylamino)-1-oxopropan-2-yl]-4-butylbenzamide
CID 68537822

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-(4-methylpentyl)benzamide?
The IUPAC name of N-hydroxy-4-(4-methylpentyl)benzamide (CID 59854516) is N-hydroxy-4-(4-methylpentyl)benzamide.
What is the SMILES notation for N-hydroxy-4-(4-methylpentyl)benzamide?
The canonical SMILES for N-hydroxy-4-(4-methylpentyl)benzamide is CC(C)CCCc1ccc(C(=O)NO)cc1.
What is the InChIKey of N-hydroxy-4-(4-methylpentyl)benzamide?
The InChIKey is UNMFSBYWNMJSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-10(2)4-3-5-11-6-8-12(9-7-11)13(15)14-16/h6-10,16H,3-5H2,1-2H3,(H,14,15).
What are the key properties of N-hydroxy-4-(4-methylpentyl)benzamide?
N-hydroxy-4-(4-methylpentyl)benzamide has a molecular weight of 221.30 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-(4-methylpentyl)benzamide is sourced from PubChem (CID 59854516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).