3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine

C15H33NO — CID 116721431

IUPAC3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine
SMILESCCCC(C)CC(NCC)C(OCC)C(C)C
InChIInChI=1S/C15H33NO/c1-7-10-13(6)11-14(16-8-2)15(12(4)5)17-9-3/h12-16H,7-11H2,1-6H3
InChIKeyFGPIMKOLQSPDEF-UHFFFAOYSA-N
MW243.43 g/mol
LogP3.85
Rot. Bonds10

About 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine

3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine (PubChem CID 116721431) has the molecular formula C15H33NO and a molecular weight of 243.43 g/mol. Its IUPAC name is 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine.

Molecular Properties

Compound Name3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine
PubChem CID116721431
Molecular FormulaC15H33NO
Molecular Weight243.43 g/mol
Exact Mass243.26
IUPAC Name3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine
SMILESCCCC(C)CC(NCC)C(OCC)C(C)C
InChIInChI=1S/C15H33NO/c1-7-10-13(6)11-14(16-8-2)15(12(4)5)17-9-3/h12-16H,7-11H2,1-6H3
InChIKeyFGPIMKOLQSPDEF-UHFFFAOYSA-N
XLogP3.85
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-Ethyl-1-piperidin-2-ylpentyl) hypofluorite
CID 144738728
(2S,3S,4S,5R)-4-fluoro-N-methyl-5-(2-methylpropyl)-2-propan-2-yloxolan-3-amine
CID 176612956
N-[[1-(1,1,1-trifluoropropan-2-yloxy)cycloheptyl]methyl]propan-2-amine
CID 66276385
1-cyclohexyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine
CID 102721862
N,4-diethyl-1-(2,2,2-trifluoroethoxy)octan-2-amine
CID 103214697
4-ethyl-N-propyl-1-(2,2,2-trifluoroethoxy)octan-2-amine
CID 103214703
1-cycloheptyl-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103216095
N-[1-cycloheptyl-2-(2,2,2-trifluoroethoxy)ethyl]propan-1-amine
CID 103216100
N-ethyl-6-methyl-1-(2,2,2-trifluoroethoxy)heptan-2-amine
CID 103216110
N,4-diethyl-1-(2,2,3,3-tetrafluoropropoxy)octan-2-amine
CID 103475837
N-[1-cyclopentyl-2-(1,1,1-trifluoropropan-2-yloxy)ethyl]propan-1-amine
CID 104749583
1-cyclopentyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 104749584

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine?
The IUPAC name of 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine (CID 116721431) is 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine.
What is the SMILES notation for 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine?
The canonical SMILES for 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine is CCCC(C)CC(NCC)C(OCC)C(C)C.
What is the InChIKey of 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine?
The InChIKey is FGPIMKOLQSPDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO/c1-7-10-13(6)11-14(16-8-2)15(12(4)5)17-9-3/h12-16H,7-11H2,1-6H3.
What are the key properties of 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine?
3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine has a molecular weight of 243.43 g/mol, XLogP of 3.85, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-ethyl-2,6-dimethylnonan-4-amine is sourced from PubChem (CID 116721431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).