2-cyclopropyl-2-methoxyethanamine

C6H13NO — CID 66072378

IUPAC2-cyclopropyl-2-methoxyethanamine
SMILESCOC(CN)C1CC1
InChIInChI=1S/C6H13NO/c1-8-6(4-7)5-2-3-5/h5-6H,2-4,7H2,1H3
InChIKeyLPIMNJFSGJOKSH-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.37
Rot. Bonds3

About 2-cyclopropyl-2-methoxyethanamine

2-cyclopropyl-2-methoxyethanamine (PubChem CID 66072378) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 2-cyclopropyl-2-methoxyethanamine.

Molecular Properties

Compound Name2-cyclopropyl-2-methoxyethanamine
PubChem CID66072378
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name2-cyclopropyl-2-methoxyethanamine
SMILESCOC(CN)C1CC1
InChIInChI=1S/C6H13NO/c1-8-6(4-7)5-2-3-5/h5-6H,2-4,7H2,1H3
InChIKeyLPIMNJFSGJOKSH-UHFFFAOYSA-N
XLogP0.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-methoxyethanamine?
The IUPAC name of 2-cyclopropyl-2-methoxyethanamine (CID 66072378) is 2-cyclopropyl-2-methoxyethanamine.
What is the SMILES notation for 2-cyclopropyl-2-methoxyethanamine?
The canonical SMILES for 2-cyclopropyl-2-methoxyethanamine is COC(CN)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-methoxyethanamine?
The InChIKey is LPIMNJFSGJOKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-8-6(4-7)5-2-3-5/h5-6H,2-4,7H2,1H3.
What are the key properties of 2-cyclopropyl-2-methoxyethanamine?
2-cyclopropyl-2-methoxyethanamine has a molecular weight of 115.18 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methoxyethanamine is sourced from PubChem (CID 66072378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).