N-butoxy-N-propylhydroxylamine

C7H17NO2 — CID 88795262

IUPACN-butoxy-N-propylhydroxylamine
SMILESCCCCON(O)CCC
InChIInChI=1S/C7H17NO2/c1-3-5-7-10-8(9)6-4-2/h9H,3-7H2,1-2H3
InChIKeyLLLSSUDXRINKNM-UHFFFAOYSA-N
MW147.22 g/mol
LogP1.82
Rot. Bonds6

About N-butoxy-N-propylhydroxylamine

N-butoxy-N-propylhydroxylamine (PubChem CID 88795262) has the molecular formula C7H17NO2 and a molecular weight of 147.22 g/mol. Its IUPAC name is N-butoxy-N-propylhydroxylamine.

Molecular Properties

Compound NameN-butoxy-N-propylhydroxylamine
PubChem CID88795262
Molecular FormulaC7H17NO2
Molecular Weight147.22 g/mol
Exact Mass147.13
IUPAC NameN-butoxy-N-propylhydroxylamine
SMILESCCCCON(O)CCC
InChIInChI=1S/C7H17NO2/c1-3-5-7-10-8(9)6-4-2/h9H,3-7H2,1-2H3
InChIKeyLLLSSUDXRINKNM-UHFFFAOYSA-N
XLogP1.82
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 51.82
H-Bond Donors ≤ 51
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

N-butoxy-N-methylmethanamine
CID 19988586
N-butoxy-N-propan-2-ylpropan-1-amine
CID 151187907
4-[butyl(4-hydroxybutoxy)amino]oxybutan-1-ol
CID 87183048
N,N-didecoxybutan-1-amine
CID 57054979
1-butylperoxybutane;hydrogen peroxide
CID 162033267
2-N,2-N,4-N,4-N,6-N,6-N-hexabutoxy-1,3,5-triazine-2,4,6-triamine
CID 22138288
2-[dodecoxy(ethyl)amino]ethanol
CID 19017012
1-butylperoxybutane
CID 159275797
N-(methylaminomethyl)-N-propylhydroxylamine
CID 89116814
cadmium;bis(1-hydroperoxybutane)
CID 134995939
hafnium;1-hydroperoxybutane
CID 159843277
N-butyl-N-(2-ethoxyethyl)hydroxylamine
CID 88829562

Frequently Asked Questions

What is the IUPAC name of N-butoxy-N-propylhydroxylamine?
The IUPAC name of N-butoxy-N-propylhydroxylamine (CID 88795262) is N-butoxy-N-propylhydroxylamine.
What is the SMILES notation for N-butoxy-N-propylhydroxylamine?
The canonical SMILES for N-butoxy-N-propylhydroxylamine is CCCCON(O)CCC.
What is the InChIKey of N-butoxy-N-propylhydroxylamine?
The InChIKey is LLLSSUDXRINKNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO2/c1-3-5-7-10-8(9)6-4-2/h9H,3-7H2,1-2H3.
What are the key properties of N-butoxy-N-propylhydroxylamine?
N-butoxy-N-propylhydroxylamine has a molecular weight of 147.22 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butoxy-N-propylhydroxylamine is sourced from PubChem (CID 88795262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).