N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine

C11H25NO — CID 83143749

IUPACN-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine
SMILESCCOCCNCC(C)C(C)(C)C
InChIInChI=1S/C11H25NO/c1-6-13-8-7-12-9-10(2)11(3,4)5/h10,12H,6-9H2,1-5H3
InChIKeyVMVOJEFFROAFLT-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.29
Rot. Bonds6

About N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine

N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine (PubChem CID 83143749) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine
PubChem CID83143749
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC NameN-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine
SMILESCCOCCNCC(C)C(C)(C)C
InChIInChI=1S/C11H25NO/c1-6-13-8-7-12-9-10(2)11(3,4)5/h10,12H,6-9H2,1-5H3
InChIKeyVMVOJEFFROAFLT-UHFFFAOYSA-N
XLogP2.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-ethoxypropyl)-2,3,3-trimethylbutan-1-amine
CID 83143458
N-(2-ethoxyethyl)-2-methylpropan-1-amine
CID 43387935
1-(2-ethoxyethylamino)propan-2-ol
CID 43393547
2,3,3-trimethyl-N-(3-methylbut-3-enyl)butan-1-amine
CID 114472495
N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen
CID 156794535
3-(2-ethoxyethylamino)-2-methylpropanoic acid;hydrochloride
CID 47003074
N-(3-ethoxypropyl)-2,3-dimethylbutan-1-amine
CID 65175065
N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2,2-dimethylpropan-1-amine
CID 138727338
4-chloro-N-(2-ethoxyethyl)pentan-1-amine
CID 106121607
2-chloro-N-(2-ethoxyethyl)-3-ethylpentan-1-amine
CID 106286235
2-ethoxy-N-ethylethanamine;hydrochloride
CID 86621180
1-[2-(2-ethoxyethylamino)ethoxy]ethanol
CID 163206684

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine?
The IUPAC name of N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine (CID 83143749) is N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine.
What is the SMILES notation for N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine?
The canonical SMILES for N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine is CCOCCNCC(C)C(C)(C)C.
What is the InChIKey of N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine?
The InChIKey is VMVOJEFFROAFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-6-13-8-7-12-9-10(2)11(3,4)5/h10,12H,6-9H2,1-5H3.
What are the key properties of N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine?
N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine has a molecular weight of 187.33 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine is sourced from PubChem (CID 83143749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).