N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine

C12H27NO — CID 87981850

IUPACN-ethyl-N-(2-methylnonan-2-yl)hydroxylamine
SMILESCCCCCCCC(C)(C)N(O)CC
InChIInChI=1S/C12H27NO/c1-5-7-8-9-10-11-12(3,4)13(14)6-2/h14H,5-11H2,1-4H3
InChIKeyKNQDCALPMGLHLY-UHFFFAOYSA-N
MW201.35 g/mol
LogP3.84
Rot. Bonds8

About N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine

N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine (PubChem CID 87981850) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine.

Molecular Properties

Compound NameN-ethyl-N-(2-methylnonan-2-yl)hydroxylamine
PubChem CID87981850
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC NameN-ethyl-N-(2-methylnonan-2-yl)hydroxylamine
SMILESCCCCCCCC(C)(C)N(O)CC
InChIInChI=1S/C12H27NO/c1-5-7-8-9-10-11-12(3,4)13(14)6-2/h14H,5-11H2,1-4H3
InChIKeyKNQDCALPMGLHLY-UHFFFAOYSA-N
XLogP3.84
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine?
The IUPAC name of N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine (CID 87981850) is N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine.
What is the SMILES notation for N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine?
The canonical SMILES for N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine is CCCCCCCC(C)(C)N(O)CC.
What is the InChIKey of N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine?
The InChIKey is KNQDCALPMGLHLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO/c1-5-7-8-9-10-11-12(3,4)13(14)6-2/h14H,5-11H2,1-4H3.
What are the key properties of N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine?
N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine has a molecular weight of 201.35 g/mol, XLogP of 3.84, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylnonan-2-yl)hydroxylamine is sourced from PubChem (CID 87981850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).