1-cyclopropyl-2-methoxyethanamine;hydrochloride

C6H14ClNO — CID 53414988

IUPAC1-cyclopropyl-2-methoxyethanamine;hydrochloride
SMILESCOCC(N)C1CC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-8-4-6(7)5-2-3-5;/h5-6H,2-4,7H2,1H3;1H
InChIKeyXKHQIVZUNCFLJO-UHFFFAOYSA-N
MW151.64 g/mol
LogP0.79
Rot. Bonds3

About 1-cyclopropyl-2-methoxyethanamine;hydrochloride

1-cyclopropyl-2-methoxyethanamine;hydrochloride (PubChem CID 53414988) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is 1-cyclopropyl-2-methoxyethanamine;hydrochloride.

Molecular Properties

Compound Name1-cyclopropyl-2-methoxyethanamine;hydrochloride
PubChem CID53414988
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name1-cyclopropyl-2-methoxyethanamine;hydrochloride
SMILESCOCC(N)C1CC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-8-4-6(7)5-2-3-5;/h5-6H,2-4,7H2,1H3;1H
InChIKeyXKHQIVZUNCFLJO-UHFFFAOYSA-N
XLogP0.79
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-methoxyethanamine;hydrochloride?
The IUPAC name of 1-cyclopropyl-2-methoxyethanamine;hydrochloride (CID 53414988) is 1-cyclopropyl-2-methoxyethanamine;hydrochloride.
What is the SMILES notation for 1-cyclopropyl-2-methoxyethanamine;hydrochloride?
The canonical SMILES for 1-cyclopropyl-2-methoxyethanamine;hydrochloride is COCC(N)C1CC1.Cl.
What is the InChIKey of 1-cyclopropyl-2-methoxyethanamine;hydrochloride?
The InChIKey is XKHQIVZUNCFLJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c1-8-4-6(7)5-2-3-5;/h5-6H,2-4,7H2,1H3;1H.
What are the key properties of 1-cyclopropyl-2-methoxyethanamine;hydrochloride?
1-cyclopropyl-2-methoxyethanamine;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-methoxyethanamine;hydrochloride is sourced from PubChem (CID 53414988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).