hydroxylamine;N-methyloctan-1-amine

C9H24N2O — CID 144676839

IUPAChydroxylamine;N-methyloctan-1-amine
SMILESCCCCCCCCNC.NO
InChIInChI=1S/C9H21N.H3NO/c1-3-4-5-6-7-8-9-10-2;1-2/h10H,3-9H2,1-2H3;2H,1H2
InChIKeyFIEJJJZWAKMRIO-UHFFFAOYSA-N
MW176.30 g/mol
LogP1.90
Rot. Bonds7

About hydroxylamine;N-methyloctan-1-amine

hydroxylamine;N-methyloctan-1-amine (PubChem CID 144676839) has the molecular formula C9H24N2O and a molecular weight of 176.30 g/mol. Its IUPAC name is hydroxylamine;N-methyloctan-1-amine.

Molecular Properties

Compound Namehydroxylamine;N-methyloctan-1-amine
PubChem CID144676839
Molecular FormulaC9H24N2O
Molecular Weight176.30 g/mol
Exact Mass176.19
IUPAC Namehydroxylamine;N-methyloctan-1-amine
SMILESCCCCCCCCNC.NO
InChIInChI=1S/C9H21N.H3NO/c1-3-4-5-6-7-8-9-10-2;1-2/h10H,3-9H2,1-2H3;2H,1H2
InChIKeyFIEJJJZWAKMRIO-UHFFFAOYSA-N
XLogP1.90
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 51.90
H-Bond Donors ≤ 53
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-methyltriacontan-1-amine
CID 19840895
N-methyloctan-1-amine;propan-1-ol
CID 88540071
N-methyltridecan-1-amine;molecular hydrogen
CID 153363446
N-methylheptan-1-amine;molecular hydrogen;propane
CID 144955567
dihydroxy(oxo)phosphanium;N-methyloctadecan-1-amine
CID 19904990
tris(N-methyldodecan-1-amine);phosphoric acid
CID 175134049
N'-dodecyl-N-methylpropane-1,3-diamine
CID 19812622
N'-hexadecyl-N-methylpropane-1,3-diamine
CID 46736042
2-hydroxyethyl(trimethyl)azanium;N-methylhexadecan-1-amine
CID 146290768
N-methylpentan-1-amine;phosphoric acid
CID 175529105
1-chloropentane;N-methyloctan-1-amine
CID 174674151
N-methylbutan-1-amine
CID 8068

Frequently Asked Questions

What is the IUPAC name of hydroxylamine;N-methyloctan-1-amine?
The IUPAC name of hydroxylamine;N-methyloctan-1-amine (CID 144676839) is hydroxylamine;N-methyloctan-1-amine.
What is the SMILES notation for hydroxylamine;N-methyloctan-1-amine?
The canonical SMILES for hydroxylamine;N-methyloctan-1-amine is CCCCCCCCNC.NO.
What is the InChIKey of hydroxylamine;N-methyloctan-1-amine?
The InChIKey is FIEJJJZWAKMRIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N.H3NO/c1-3-4-5-6-7-8-9-10-2;1-2/h10H,3-9H2,1-2H3;2H,1H2.
What are the key properties of hydroxylamine;N-methyloctan-1-amine?
hydroxylamine;N-methyloctan-1-amine has a molecular weight of 176.30 g/mol, XLogP of 1.90, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxylamine;N-methyloctan-1-amine is sourced from PubChem (CID 144676839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).