O-hexadecan-2-ylhydroxylamine

C16H35NO — CID 18799052

IUPACO-hexadecan-2-ylhydroxylamine
SMILESCCCCCCCCCCCCCCC(C)ON
InChIInChI=1S/C16H35NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)18-17/h16H,3-15,17H2,1-2H3
InChIKeyXVWKSEQRRDCMFU-UHFFFAOYSA-N
MW257.46 g/mol
LogP5.36
Rot. Bonds14

About O-hexadecan-2-ylhydroxylamine

O-hexadecan-2-ylhydroxylamine (PubChem CID 18799052) has the molecular formula C16H35NO and a molecular weight of 257.46 g/mol. Its IUPAC name is O-hexadecan-2-ylhydroxylamine.

Molecular Properties

Compound NameO-hexadecan-2-ylhydroxylamine
PubChem CID18799052
Molecular FormulaC16H35NO
Molecular Weight257.46 g/mol
Exact Mass257.27
IUPAC NameO-hexadecan-2-ylhydroxylamine
SMILESCCCCCCCCCCCCCCC(C)ON
InChIInChI=1S/C16H35NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)18-17/h16H,3-15,17H2,1-2H3
InChIKeyXVWKSEQRRDCMFU-UHFFFAOYSA-N
XLogP5.36
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500257.46
LogP ≤ 55.36
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'}

Analyze O-hexadecan-2-ylhydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

sulfuric acid;O-tetradecan-2-ylhydroxylamine
CID 88818461
tetradecan-2-yloxysilane
CID 173015270
O-(1-aminoheptyl)hydroxylamine
CID 89080647
2-ethoxytridecane
CID 54143367
(6S)-6-aminooxyheptane-1,1-diol
CID 163412308
bis[(2R)-octan-2-yl] [(2S)-octan-2-yl] borate
CID 99771040
1-octan-2-yloxydecane
CID 86220707
di(undecan-2-yloxy)silane
CID 123423274
di(decan-2-yloxy)silane
CID 123195552
1-nonan-2-yloxyoctadecane
CID 88815684
2-decoxyundecane
CID 151498473
1-undecan-2-yloxypentadecane
CID 174433069

Frequently Asked Questions

What is the IUPAC name of O-hexadecan-2-ylhydroxylamine?
The IUPAC name of O-hexadecan-2-ylhydroxylamine (CID 18799052) is O-hexadecan-2-ylhydroxylamine.
What is the SMILES notation for O-hexadecan-2-ylhydroxylamine?
The canonical SMILES for O-hexadecan-2-ylhydroxylamine is CCCCCCCCCCCCCCC(C)ON.
What is the InChIKey of O-hexadecan-2-ylhydroxylamine?
The InChIKey is XVWKSEQRRDCMFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)18-17/h16H,3-15,17H2,1-2H3.
What are the key properties of O-hexadecan-2-ylhydroxylamine?
O-hexadecan-2-ylhydroxylamine has a molecular weight of 257.46 g/mol, XLogP of 5.36, 14 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-hexadecan-2-ylhydroxylamine is sourced from PubChem (CID 18799052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).