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

C10H23NO — CID 145316981

IUPACN-ethyl-N-(2-methylheptan-2-yl)hydroxylamine
SMILESCCCCCC(C)(C)N(O)CC
InChIInChI=1S/C10H23NO/c1-5-7-8-9-10(3,4)11(12)6-2/h12H,5-9H2,1-4H3
InChIKeyJOEVLTYMGBFOBK-UHFFFAOYSA-N
MW173.30 g/mol
LogP3.06
Rot. Bonds6

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

N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine (PubChem CID 145316981) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine.

Molecular Properties

Compound NameN-ethyl-N-(2-methylheptan-2-yl)hydroxylamine
PubChem CID145316981
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC NameN-ethyl-N-(2-methylheptan-2-yl)hydroxylamine
SMILESCCCCCC(C)(C)N(O)CC
InChIInChI=1S/C10H23NO/c1-5-7-8-9-10(3,4)11(12)6-2/h12H,5-9H2,1-4H3
InChIKeyJOEVLTYMGBFOBK-UHFFFAOYSA-N
XLogP3.06
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 53.06
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-methylheptan-2-yl)hydroxylamine?
The IUPAC name of N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine (CID 145316981) is N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine.
What is the SMILES notation for N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine?
The canonical SMILES for N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine is CCCCCC(C)(C)N(O)CC.
What is the InChIKey of N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine?
The InChIKey is JOEVLTYMGBFOBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-5-7-8-9-10(3,4)11(12)6-2/h12H,5-9H2,1-4H3.
What are the key properties of N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine?
N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine has a molecular weight of 173.30 g/mol, XLogP of 3.06, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylheptan-2-yl)hydroxylamine is sourced from PubChem (CID 145316981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).