N-hydroxy-5-(4-nitrophenyl)pentanamide

C11H14N2O4 — CID 142619075

IUPACN-hydroxy-5-(4-nitrophenyl)pentanamide
SMILESO=C(CCCCc1ccc([N+](=O)[O-])cc1)NO
InChIInChI=1S/C11H14N2O4/c14-11(12-15)4-2-1-3-9-5-7-10(8-6-9)13(16)17/h5-8,15H,1-4H2,(H,12,14)
InChIKeyRTKKYPWJAMZTMS-UHFFFAOYSA-N
MW238.24 g/mol
LogP1.81
Rot. Bonds6

About N-hydroxy-5-(4-nitrophenyl)pentanamide

N-hydroxy-5-(4-nitrophenyl)pentanamide (PubChem CID 142619075) has the molecular formula C11H14N2O4 and a molecular weight of 238.24 g/mol. Its IUPAC name is N-hydroxy-5-(4-nitrophenyl)pentanamide.

Molecular Properties

Compound NameN-hydroxy-5-(4-nitrophenyl)pentanamide
PubChem CID142619075
Molecular FormulaC11H14N2O4
Molecular Weight238.24 g/mol
Exact Mass238.10
IUPAC NameN-hydroxy-5-(4-nitrophenyl)pentanamide
SMILESO=C(CCCCc1ccc([N+](=O)[O-])cc1)NO
InChIInChI=1S/C11H14N2O4/c14-11(12-15)4-2-1-3-9-5-7-10(8-6-9)13(16)17/h5-8,15H,1-4H2,(H,12,14)
InChIKeyRTKKYPWJAMZTMS-UHFFFAOYSA-N
XLogP1.81
TPSA92.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.24
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-[4-(4-nitrophenyl)butyl]propanamide
CID 119320506
3-amino-N-[4-(4-nitrophenyl)butyl]propanamide;hydrochloride
CID 119320505
3-(4-nitrophenyl)propanoate
CID 6923582
N-[2-(4-nitrophenyl)ethyl]pentanamide
CID 110294427
4-(4-bromophenyl)-N-hydroxybutanamide
CID 139305557
2-methyl-6-(4-nitrophenyl)hexan-3-one
CID 43520086
N-[3-(4-nitrophenyl)propyl]acetamide
CID 58774168
bis[2-(4-nitrophenyl)ethyl] hexanedioate
CID 132820351
N-[[6-(hydroxyamino)-6-oxohexyl]carbamoyl]-4-nitrobenzamide
CID 46890621
(E)-1-(4-nitrophenyl)-6-phenylhex-1-en-3-one
CID 11426428
4-(4-nitrophenyl)butylazanium bromide
CID 163585899
6-(4-nitrophenyl)hexane-1-thiol
CID 10586091

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-5-(4-nitrophenyl)pentanamide?
The IUPAC name of N-hydroxy-5-(4-nitrophenyl)pentanamide (CID 142619075) is N-hydroxy-5-(4-nitrophenyl)pentanamide.
What is the SMILES notation for N-hydroxy-5-(4-nitrophenyl)pentanamide?
The canonical SMILES for N-hydroxy-5-(4-nitrophenyl)pentanamide is O=C(CCCCc1ccc([N+](=O)[O-])cc1)NO.
What is the InChIKey of N-hydroxy-5-(4-nitrophenyl)pentanamide?
The InChIKey is RTKKYPWJAMZTMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O4/c14-11(12-15)4-2-1-3-9-5-7-10(8-6-9)13(16)17/h5-8,15H,1-4H2,(H,12,14).
What are the key properties of N-hydroxy-5-(4-nitrophenyl)pentanamide?
N-hydroxy-5-(4-nitrophenyl)pentanamide has a molecular weight of 238.24 g/mol, XLogP of 1.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-5-(4-nitrophenyl)pentanamide is sourced from PubChem (CID 142619075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).