2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine

C15H33NO — CID 112591499

IUPAC2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine
SMILESCCCCC(CC)(CCOC(C)(C)C)CNC
InChIInChI=1S/C15H33NO/c1-7-9-10-15(8-2,13-16-6)11-12-17-14(3,4)5/h16H,7-13H2,1-6H3
InChIKeyAZFPQLCLGNBBKF-UHFFFAOYSA-N
MW243.43 g/mol
LogP4.00
Rot. Bonds9

About 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine

2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine (PubChem CID 112591499) has the molecular formula C15H33NO and a molecular weight of 243.43 g/mol. Its IUPAC name is 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine
PubChem CID112591499
Molecular FormulaC15H33NO
Molecular Weight243.43 g/mol
Exact Mass243.26
IUPAC Name2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine
SMILESCCCCC(CC)(CCOC(C)(C)C)CNC
InChIInChI=1S/C15H33NO/c1-7-9-10-15(8-2,13-16-6)11-12-17-14(3,4)5/h16H,7-13H2,1-6H3
InChIKeyAZFPQLCLGNBBKF-UHFFFAOYSA-N
XLogP4.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-N-propan-2-ylhexan-1-amine
CID 112591502
2-ethyl-N-(2-methoxyethyl)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine
CID 115943404
3-(chloromethyl)-3-ethyl-1-[(2-methylpropan-2-yl)oxy]heptane
CID 112592393
2-ethyl-N-methyl-2-(2-methylpropyl)hexan-1-amine
CID 62725827
2-ethyl-N-methyl-2-(2-methylsulfonylethyl)hexan-1-amine
CID 62723627
2,2-diethyl-4-[(2-methylpropan-2-yl)oxy]butan-1-amine
CID 112591457
3,3-diethyl-6,6-dimethyl-1-[(2-methylpropan-2-yl)oxy]heptane
CID 89254911
N,2-dimethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]butan-1-amine
CID 112589696
2-ethyl-N,N'-dimethyl-2-(methylaminomethyl)propane-1,3-diamine
CID 59289836
N-tert-butyl-2-ethyl-2-propylhexan-1-amine
CID 63507407
2-(cyclohexylmethyl)-2-ethyl-N-methylhexan-1-amine
CID 55194903
5,8-dibutyl-5,8-diethyldodecane
CID 140960006

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine?
The IUPAC name of 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine (CID 112591499) is 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine.
What is the SMILES notation for 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine?
The canonical SMILES for 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine is CCCCC(CC)(CCOC(C)(C)C)CNC.
What is the InChIKey of 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine?
The InChIKey is AZFPQLCLGNBBKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO/c1-7-9-10-15(8-2,13-16-6)11-12-17-14(3,4)5/h16H,7-13H2,1-6H3.
What are the key properties of 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine?
2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine has a molecular weight of 243.43 g/mol, XLogP of 4.00, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]hexan-1-amine is sourced from PubChem (CID 112591499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).