N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine

C11H25NO2 — CID 112590002

IUPACN-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine
SMILESCCNCC(C)OCCOC(C)(C)C
InChIInChI=1S/C11H25NO2/c1-6-12-9-10(2)13-7-8-14-11(3,4)5/h10,12H,6-9H2,1-5H3
InChIKeyKYMAQBDVJCYBAV-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.82
Rot. Bonds7

About N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine

N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine (PubChem CID 112590002) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine
PubChem CID112590002
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC NameN-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine
SMILESCCNCC(C)OCCOC(C)(C)C
InChIInChI=1S/C11H25NO2/c1-6-12-9-10(2)13-7-8-14-11(3,4)5/h10,12H,6-9H2,1-5H3
InChIKeyKYMAQBDVJCYBAV-UHFFFAOYSA-N
XLogP1.82
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 112590123
2-methyl-N-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propyl]propan-2-amine
CID 112589746
2-butoxy-N-ethylpropan-1-amine
CID 62449884
N-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propyl]cyclopropanamine
CID 112589849
2,2-dimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentane
CID 162034273
2-(ethylamino)-2-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanoic acid
CID 112589153
N-ethyl-2-prop-2-enoxypropan-1-amine
CID 62442088
4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide
CID 112590279
(2S)-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]butan-2-ol
CID 103939578
N,N'-bis[2-(2-methoxyethoxy)propyl]ethane-1,2-diamine
CID 58589932
ethyl 2-amino-2-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanoate
CID 112589158
N-ethyl-2,2-dimethyl-4-[(2-methylpropan-2-yl)oxy]butan-1-amine
CID 112591463

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine?
The IUPAC name of N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine (CID 112590002) is N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine.
What is the SMILES notation for N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine?
The canonical SMILES for N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine is CCNCC(C)OCCOC(C)(C)C.
What is the InChIKey of N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine?
The InChIKey is KYMAQBDVJCYBAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-6-12-9-10(2)13-7-8-14-11(3,4)5/h10,12H,6-9H2,1-5H3.
What are the key properties of N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine?
N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 1.82, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine is sourced from PubChem (CID 112590002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).