N-(12-aminododecoxy)hydroxylamine

C12H28N2O2 — CID 175865431

IUPACN-(12-aminododecoxy)hydroxylamine
SMILESNCCCCCCCCCCCCONO
InChIInChI=1S/C12H28N2O2/c13-11-9-7-5-3-1-2-4-6-8-10-12-16-14-15/h14-15H,1-13H2
InChIKeyPJFYIDVUOIWUHH-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.76
Rot. Bonds13

About N-(12-aminododecoxy)hydroxylamine

N-(12-aminododecoxy)hydroxylamine (PubChem CID 175865431) has the molecular formula C12H28N2O2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-(12-aminododecoxy)hydroxylamine.

Molecular Properties

Compound NameN-(12-aminododecoxy)hydroxylamine
PubChem CID175865431
Molecular FormulaC12H28N2O2
Molecular Weight232.37 g/mol
Exact Mass232.22
IUPAC NameN-(12-aminododecoxy)hydroxylamine
SMILESNCCCCCCCCCCCCONO
InChIInChI=1S/C12H28N2O2/c13-11-9-7-5-3-1-2-4-6-8-10-12-16-14-15/h14-15H,1-13H2
InChIKeyPJFYIDVUOIWUHH-UHFFFAOYSA-N
XLogP2.76
TPSA67.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

4-aminobutoxycarbamic acid
CID 87755942
N"-(4-aminobutoxy)methanetriamine
CID 142009330
11-(11-aminoundecoxy)undecan-1-amine
CID 19099845
2-(5-aminopentylamino)oxyethanol
CID 88588722
ethane-1,2-diamine;hexane-1,6-diamine;propane-1,3-diamine
CID 174976752
O-(13-aminotridecyl)hydroxylamine
CID 174386502
(1S,2S,4S,5R)-6-(6-aminohexoxy)cyclohexane-1,2,3,4,5-pentol
CID 57203163
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
bis(6-aminohexyl) carbonate
CID 87932900
9-aminononyl carbamate
CID 87884060

Frequently Asked Questions

What is the IUPAC name of N-(12-aminododecoxy)hydroxylamine?
The IUPAC name of N-(12-aminododecoxy)hydroxylamine (CID 175865431) is N-(12-aminododecoxy)hydroxylamine.
What is the SMILES notation for N-(12-aminododecoxy)hydroxylamine?
The canonical SMILES for N-(12-aminododecoxy)hydroxylamine is NCCCCCCCCCCCCONO.
What is the InChIKey of N-(12-aminododecoxy)hydroxylamine?
The InChIKey is PJFYIDVUOIWUHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2O2/c13-11-9-7-5-3-1-2-4-6-8-10-12-16-14-15/h14-15H,1-13H2.
What are the key properties of N-(12-aminododecoxy)hydroxylamine?
N-(12-aminododecoxy)hydroxylamine has a molecular weight of 232.37 g/mol, XLogP of 2.76, 13 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(12-aminododecoxy)hydroxylamine is sourced from PubChem (CID 175865431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).