N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine

C12H25NO — CID 105008985

IUPACN-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
SMILESCCNC(COC)C1C(C)(C)C1(C)C
InChIInChI=1S/C12H25NO/c1-7-13-9(8-14-6)10-11(2,3)12(10,4)5/h9-10,13H,7-8H2,1-6H3
InChIKeyDDZOQMZKSRCAHL-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.29
Rot. Bonds5

About N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine

N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine (PubChem CID 105008985) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
PubChem CID105008985
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
SMILESCCNC(COC)C1C(C)(C)C1(C)C
InChIInChI=1S/C12H25NO/c1-7-13-9(8-14-6)10-11(2,3)12(10,4)5/h9-10,13H,7-8H2,1-6H3
InChIKeyDDZOQMZKSRCAHL-UHFFFAOYSA-N
XLogP2.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
The IUPAC name of N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine (CID 105008985) is N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine.
What is the SMILES notation for N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
The canonical SMILES for N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine is CCNC(COC)C1C(C)(C)C1(C)C.
What is the InChIKey of N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
The InChIKey is DDZOQMZKSRCAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-7-13-9(8-14-6)10-11(2,3)12(10,4)5/h9-10,13H,7-8H2,1-6H3.
What are the key properties of N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine?
N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine has a molecular weight of 199.34 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine is sourced from PubChem (CID 105008985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).