[1-(2-ethoxyethyl)cyclopentyl]methanamine

C10H21NO — CID 62724287

IUPAC[1-(2-ethoxyethyl)cyclopentyl]methanamine
SMILESCCOCCC1(CN)CCCC1
InChIInChI=1S/C10H21NO/c1-2-12-8-7-10(9-11)5-3-4-6-10/h2-9,11H2,1H3
InChIKeyROBOTMSCERGPLX-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.93
Rot. Bonds5

About [1-(2-ethoxyethyl)cyclopentyl]methanamine

[1-(2-ethoxyethyl)cyclopentyl]methanamine (PubChem CID 62724287) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is [1-(2-ethoxyethyl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(2-ethoxyethyl)cyclopentyl]methanamine
PubChem CID62724287
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name[1-(2-ethoxyethyl)cyclopentyl]methanamine
SMILESCCOCCC1(CN)CCCC1
InChIInChI=1S/C10H21NO/c1-2-12-8-7-10(9-11)5-3-4-6-10/h2-9,11H2,1H3
InChIKeyROBOTMSCERGPLX-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [1-(2-ethoxyethyl)cyclopentyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(2-ethoxyethyl)cyclopentyl]methanamine?
The IUPAC name of [1-(2-ethoxyethyl)cyclopentyl]methanamine (CID 62724287) is [1-(2-ethoxyethyl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(2-ethoxyethyl)cyclopentyl]methanamine?
The canonical SMILES for [1-(2-ethoxyethyl)cyclopentyl]methanamine is CCOCCC1(CN)CCCC1.
What is the InChIKey of [1-(2-ethoxyethyl)cyclopentyl]methanamine?
The InChIKey is ROBOTMSCERGPLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-2-12-8-7-10(9-11)5-3-4-6-10/h2-9,11H2,1H3.
What are the key properties of [1-(2-ethoxyethyl)cyclopentyl]methanamine?
[1-(2-ethoxyethyl)cyclopentyl]methanamine has a molecular weight of 171.28 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethoxyethyl)cyclopentyl]methanamine is sourced from PubChem (CID 62724287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).