4-(2-ethoxyethylamino)cyclohexan-1-ol

C10H21NO2 — CID 103604849

IUPAC4-(2-ethoxyethylamino)cyclohexan-1-ol
SMILESCCOCCNC1CCC(O)CC1
InChIInChI=1S/C10H21NO2/c1-2-13-8-7-11-9-3-5-10(12)6-4-9/h9-12H,2-8H2,1H3
InChIKeySNCAZMKAXJATMX-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.92
Rot. Bonds5

About 4-(2-ethoxyethylamino)cyclohexan-1-ol

4-(2-ethoxyethylamino)cyclohexan-1-ol (PubChem CID 103604849) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 4-(2-ethoxyethylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2-ethoxyethylamino)cyclohexan-1-ol
PubChem CID103604849
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name4-(2-ethoxyethylamino)cyclohexan-1-ol
SMILESCCOCCNC1CCC(O)CC1
InChIInChI=1S/C10H21NO2/c1-2-13-8-7-11-9-3-5-10(12)6-4-9/h9-12H,2-8H2,1H3
InChIKeySNCAZMKAXJATMX-UHFFFAOYSA-N
XLogP0.92
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-(2-ethoxyethylamino)cyclohexan-1-ol 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 4-(2-ethoxyethylamino)cyclohexan-1-ol?
The IUPAC name of 4-(2-ethoxyethylamino)cyclohexan-1-ol (CID 103604849) is 4-(2-ethoxyethylamino)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-ethoxyethylamino)cyclohexan-1-ol?
The canonical SMILES for 4-(2-ethoxyethylamino)cyclohexan-1-ol is CCOCCNC1CCC(O)CC1.
What is the InChIKey of 4-(2-ethoxyethylamino)cyclohexan-1-ol?
The InChIKey is SNCAZMKAXJATMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-2-13-8-7-11-9-3-5-10(12)6-4-9/h9-12H,2-8H2,1H3.
What are the key properties of 4-(2-ethoxyethylamino)cyclohexan-1-ol?
4-(2-ethoxyethylamino)cyclohexan-1-ol has a molecular weight of 187.28 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyethylamino)cyclohexan-1-ol is sourced from PubChem (CID 103604849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).