O-pentylhydroxylamine

C5H13NO — CID 13245201

IUPACO-pentylhydroxylamine
SMILESCCCCCON
InChIInChI=1S/C5H13NO/c1-2-3-4-5-7-6/h2-6H2,1H3
InChIKeyVBPVZDFRUFVPDV-UHFFFAOYSA-N
MW103.17 g/mol
LogP1.07
Rot. Bonds4

About O-pentylhydroxylamine

O-pentylhydroxylamine (PubChem CID 13245201) has the molecular formula C5H13NO and a molecular weight of 103.17 g/mol. Its IUPAC name is O-pentylhydroxylamine.

Molecular Properties

Compound NameO-pentylhydroxylamine
PubChem CID13245201
Molecular FormulaC5H13NO
Molecular Weight103.17 g/mol
Exact Mass103.10
IUPAC NameO-pentylhydroxylamine
SMILESCCCCCON
InChIInChI=1S/C5H13NO/c1-2-3-4-5-7-6/h2-6H2,1H3
InChIKeyVBPVZDFRUFVPDV-UHFFFAOYSA-N
XLogP1.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of O-pentylhydroxylamine?
The IUPAC name of O-pentylhydroxylamine (CID 13245201) is O-pentylhydroxylamine.
What is the SMILES notation for O-pentylhydroxylamine?
The canonical SMILES for O-pentylhydroxylamine is CCCCCON.
What is the InChIKey of O-pentylhydroxylamine?
The InChIKey is VBPVZDFRUFVPDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO/c1-2-3-4-5-7-6/h2-6H2,1H3.
What are the key properties of O-pentylhydroxylamine?
O-pentylhydroxylamine has a molecular weight of 103.17 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-pentylhydroxylamine is sourced from PubChem (CID 13245201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).