O-(5-methylhexan-3-yl)hydroxylamine

C7H17NO — CID 174294741

IUPACO-(5-methylhexan-3-yl)hydroxylamine
SMILESCCC(CC(C)C)ON
InChIInChI=1S/C7H17NO/c1-4-7(9-8)5-6(2)3/h6-7H,4-5,8H2,1-3H3
InChIKeyLJLHAUGTSZEAAN-UHFFFAOYSA-N
MW131.22 g/mol
LogP1.70
Rot. Bonds4

About O-(5-methylhexan-3-yl)hydroxylamine

O-(5-methylhexan-3-yl)hydroxylamine (PubChem CID 174294741) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is O-(5-methylhexan-3-yl)hydroxylamine.

Molecular Properties

Compound NameO-(5-methylhexan-3-yl)hydroxylamine
PubChem CID174294741
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC NameO-(5-methylhexan-3-yl)hydroxylamine
SMILESCCC(CC(C)C)ON
InChIInChI=1S/C7H17NO/c1-4-7(9-8)5-6(2)3/h6-7H,4-5,8H2,1-3H3
InChIKeyLJLHAUGTSZEAAN-UHFFFAOYSA-N
XLogP1.70
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

O-(1-amino-4-methylpentan-2-yl)hydroxylamine
CID 118970501
2-methyl-4-[(2-methylpropan-2-yl)oxy]hexane
CID 91528197
CID 22216930
CID 22216930
4-(2,6-dimethylheptan-4-yloxy)-2,6-dimethylheptane
CID 18359494
O-[1-(methylamino)butan-2-yl]hydroxylamine
CID 118650526
(4S)-2,5-dimethylheptan-4-amine
CID 145304890
2-methyl-4-(2-methylheptan-4-yloxy)heptane
CID 22758032
alumane;2,4,5-trimethylheptane
CID 174508217
ethane;2,4,5-trimethylheptane
CID 142268679
tris(2,6-dimethylheptan-4-yloxy)silane
CID 175859767
(2S)-2-methoxybutan-1-amine
CID 42427147
CID 167440331
CID 167440331

Frequently Asked Questions

What is the IUPAC name of O-(5-methylhexan-3-yl)hydroxylamine?
The IUPAC name of O-(5-methylhexan-3-yl)hydroxylamine (CID 174294741) is O-(5-methylhexan-3-yl)hydroxylamine.
What is the SMILES notation for O-(5-methylhexan-3-yl)hydroxylamine?
The canonical SMILES for O-(5-methylhexan-3-yl)hydroxylamine is CCC(CC(C)C)ON.
What is the InChIKey of O-(5-methylhexan-3-yl)hydroxylamine?
The InChIKey is LJLHAUGTSZEAAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO/c1-4-7(9-8)5-6(2)3/h6-7H,4-5,8H2,1-3H3.
What are the key properties of O-(5-methylhexan-3-yl)hydroxylamine?
O-(5-methylhexan-3-yl)hydroxylamine has a molecular weight of 131.22 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-(5-methylhexan-3-yl)hydroxylamine is sourced from PubChem (CID 174294741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).