2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine

C11H25NO — CID 146577088

IUPAC2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine
SMILESCCOC(CN(C)CC)C(C)(C)C
InChIInChI=1S/C11H25NO/c1-7-12(6)9-10(13-8-2)11(3,4)5/h10H,7-9H2,1-6H3
InChIKeyDJZQODIVSKAHMD-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.39
Rot. Bonds5

About 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine

2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine (PubChem CID 146577088) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine.

Molecular Properties

Compound Name2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine
PubChem CID146577088
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine
SMILESCCOC(CN(C)CC)C(C)(C)C
InChIInChI=1S/C11H25NO/c1-7-12(6)9-10(13-8-2)11(3,4)5/h10H,7-9H2,1-6H3
InChIKeyDJZQODIVSKAHMD-UHFFFAOYSA-N
XLogP2.39
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-ethoxy-2,2-dimethylpentane
CID 88893623
2-ethoxy-N'-ethyl-N'-methylpropane-1,3-diamine
CID 63070797
(2R)-1-[ethyl(methyl)amino]propane-2-thiol
CID 134269969
N-(2,2-diethoxyethyl)-2,2,2-trifluoro-N-methylethanamine
CID 63618857
N-ethyl-N,2,4,4-tetramethylpentan-1-amine
CID 163702112
ethane;N-ethyl-N,2-dimethylpropan-1-amine
CID 143400672
N,4-diethyl-N,2,4-trimethylhexan-1-amine
CID 123611396
2-ethoxy-N'-methyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 63071578
N'-ethyl-1-methoxy-N,N,N'-trimethylethane-1,2-diamine
CID 178173118
2-ethoxy-3,3-dimethylbutanenitrile
CID 66073387
ethane;N-ethyl-2-methoxy-N-methylpropan-1-amine
CID 145315880
1-N-ethyl-1-N,2-dimethylpropane-1,2-diamine
CID 61265281

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine?
The IUPAC name of 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine (CID 146577088) is 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine.
What is the SMILES notation for 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine?
The canonical SMILES for 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine is CCOC(CN(C)CC)C(C)(C)C.
What is the InChIKey of 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine?
The InChIKey is DJZQODIVSKAHMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-7-12(6)9-10(13-8-2)11(3,4)5/h10H,7-9H2,1-6H3.
What are the key properties of 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine?
2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine has a molecular weight of 187.33 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-ethyl-N,3,3-trimethylbutan-1-amine is sourced from PubChem (CID 146577088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).