1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride

C8H18ClNO — CID 53440233

IUPAC1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride
SMILESCCOCC1(N)CCCC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-2-10-7-8(9)5-3-4-6-8;/h2-7,9H2,1H3;1H
InChIKeyKEJBFYREJMNEPD-UHFFFAOYSA-N
MW179.69 g/mol
LogP1.72
Rot. Bonds3

About 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride

1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride (PubChem CID 53440233) has the molecular formula C8H18ClNO and a molecular weight of 179.69 g/mol. Its IUPAC name is 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride
PubChem CID53440233
Molecular FormulaC8H18ClNO
Molecular Weight179.69 g/mol
Exact Mass179.11
IUPAC Name1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride
SMILESCCOCC1(N)CCCC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-2-10-7-8(9)5-3-4-6-8;/h2-7,9H2,1H3;1H
InChIKeyKEJBFYREJMNEPD-UHFFFAOYSA-N
XLogP1.72
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.69
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride?
The IUPAC name of 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride (CID 53440233) is 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride.
What is the SMILES notation for 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride?
The canonical SMILES for 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride is CCOCC1(N)CCCC1.Cl.
What is the InChIKey of 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride?
The InChIKey is KEJBFYREJMNEPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.ClH/c1-2-10-7-8(9)5-3-4-6-8;/h2-7,9H2,1H3;1H.
What are the key properties of 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride?
1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride has a molecular weight of 179.69 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxymethyl)cyclopentan-1-amine;hydrochloride is sourced from PubChem (CID 53440233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).