2-(2-ethoxyethylamino)cycloheptan-1-ol

C11H23NO2 — CID 60910202

IUPAC2-(2-ethoxyethylamino)cycloheptan-1-ol
SMILESCCOCCNC1CCCCCC1O
InChIInChI=1S/C11H23NO2/c1-2-14-9-8-12-10-6-4-3-5-7-11(10)13/h10-13H,2-9H2,1H3
InChIKeyCPHBTYDEXWSZJX-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.31
Rot. Bonds5

About 2-(2-ethoxyethylamino)cycloheptan-1-ol

2-(2-ethoxyethylamino)cycloheptan-1-ol (PubChem CID 60910202) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-(2-ethoxyethylamino)cycloheptan-1-ol.

Molecular Properties

Compound Name2-(2-ethoxyethylamino)cycloheptan-1-ol
PubChem CID60910202
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-(2-ethoxyethylamino)cycloheptan-1-ol
SMILESCCOCCNC1CCCCCC1O
InChIInChI=1S/C11H23NO2/c1-2-14-9-8-12-10-6-4-3-5-7-11(10)13/h10-13H,2-9H2,1H3
InChIKeyCPHBTYDEXWSZJX-UHFFFAOYSA-N
XLogP1.31
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[(2-Hydroxyethyl)amino]-2-dodecanol
CID 10988562
1-(2-Hydroxyethylamino)decan-2-ol
CID 20261256
1-(Propan-2-ylamino)octan-2-ol
CID 20261253
cis-(1S,2R)-2-(methylamino)cycloheptan-1-ol
CID 92784900
2-[2-(2,2,2-Trifluoroethoxy)ethylamino]cycloheptan-1-ol
CID 55262225
cis-(1R,2S)-2-(butylamino)cycloheptan-1-ol;hydrochloride
CID 90662649
cis-(1R,2S)-2-(butylamino)cycloheptan-1-ol
CID 90662650
2-(1,1-Difluoropropan-2-ylamino)cycloheptan-1-ol
CID 102869994
2-[(3,3,3-Trifluoro-2-hydroxypropyl)amino]cycloheptan-1-ol
CID 104280720
2-(2-Fluoroethylamino)cycloheptan-1-ol
CID 104280748
2-(3-Fluoropropylamino)cycloheptan-1-ol
CID 104280881
2-[2-(Trifluoromethoxy)ethylamino]cycloheptan-1-ol
CID 104280902

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethylamino)cycloheptan-1-ol?
The IUPAC name of 2-(2-ethoxyethylamino)cycloheptan-1-ol (CID 60910202) is 2-(2-ethoxyethylamino)cycloheptan-1-ol.
What is the SMILES notation for 2-(2-ethoxyethylamino)cycloheptan-1-ol?
The canonical SMILES for 2-(2-ethoxyethylamino)cycloheptan-1-ol is CCOCCNC1CCCCCC1O.
What is the InChIKey of 2-(2-ethoxyethylamino)cycloheptan-1-ol?
The InChIKey is CPHBTYDEXWSZJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-2-14-9-8-12-10-6-4-3-5-7-11(10)13/h10-13H,2-9H2,1H3.
What are the key properties of 2-(2-ethoxyethylamino)cycloheptan-1-ol?
2-(2-ethoxyethylamino)cycloheptan-1-ol has a molecular weight of 201.31 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethylamino)cycloheptan-1-ol is sourced from PubChem (CID 60910202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).