O-(13-aminotridecyl)hydroxylamine

C13H30N2O — CID 174386502

IUPACO-(13-aminotridecyl)hydroxylamine
SMILESNCCCCCCCCCCCCCON
InChIInChI=1S/C13H30N2O/c14-12-10-8-6-4-2-1-3-5-7-9-11-13-16-15/h1-15H2
InChIKeyYZGVHJHKLKBJPU-UHFFFAOYSA-N
MW230.40 g/mol
LogP3.13
Rot. Bonds13

About O-(13-aminotridecyl)hydroxylamine

O-(13-aminotridecyl)hydroxylamine (PubChem CID 174386502) has the molecular formula C13H30N2O and a molecular weight of 230.40 g/mol. Its IUPAC name is O-(13-aminotridecyl)hydroxylamine.

Molecular Properties

Compound NameO-(13-aminotridecyl)hydroxylamine
PubChem CID174386502
Molecular FormulaC13H30N2O
Molecular Weight230.40 g/mol
Exact Mass230.24
IUPAC NameO-(13-aminotridecyl)hydroxylamine
SMILESNCCCCCCCCCCCCCON
InChIInChI=1S/C13H30N2O/c14-12-10-8-6-4-2-1-3-5-7-9-11-13-16-15/h1-15H2
InChIKeyYZGVHJHKLKBJPU-UHFFFAOYSA-N
XLogP3.13
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.40
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Related Compounds

bis(O-(4-aminobutyl)hydroxylamine);dihydrochloride
CID 173302500
O-(12-aminooxydodecyl)hydroxylamine
CID 134994458
11-(11-aminoundecoxy)undecan-1-amine
CID 19099845
ethane-1,2-diamine;hexane-1,6-diamine;propane-1,3-diamine
CID 174976752
octatriacontane-1,38-diamine
CID 54235792
icosane-1,20-diamine;nonadecane-1,19-diamine
CID 155315822
decane-1,10-diamine;nonane-1,9-diamine
CID 18179225
O-nonadecylhydroxylamine
CID 59050271
5-(2-aminoethoxy)pentan-1-amine
CID 58473832
6-[2-(3-aminopropoxy)ethoxy]hexan-1-amine
CID 87252227
O-octacosylhydroxylamine
CID 151286755
12-silyloxydodecan-1-amine
CID 175006920

Frequently Asked Questions

What is the IUPAC name of O-(13-aminotridecyl)hydroxylamine?
The IUPAC name of O-(13-aminotridecyl)hydroxylamine (CID 174386502) is O-(13-aminotridecyl)hydroxylamine.
What is the SMILES notation for O-(13-aminotridecyl)hydroxylamine?
The canonical SMILES for O-(13-aminotridecyl)hydroxylamine is NCCCCCCCCCCCCCON.
What is the InChIKey of O-(13-aminotridecyl)hydroxylamine?
The InChIKey is YZGVHJHKLKBJPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O/c14-12-10-8-6-4-2-1-3-5-7-9-11-13-16-15/h1-15H2.
What are the key properties of O-(13-aminotridecyl)hydroxylamine?
O-(13-aminotridecyl)hydroxylamine has a molecular weight of 230.40 g/mol, XLogP of 3.13, 13 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(13-aminotridecyl)hydroxylamine is sourced from PubChem (CID 174386502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).