2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol

C15H22ClNO2 — CID 62014085

IUPAC2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol
SMILESOCCN(CCOc1ccccc1Cl)C1CCCC1
InChIInChI=1S/C15H22ClNO2/c16-14-7-3-4-8-15(14)19-12-10-17(9-11-18)13-5-1-2-6-13/h3-4,7-8,13,18H,1-2,5-6,9-12H2
InChIKeyMCMFXYMSKZIXQR-UHFFFAOYSA-N
MW283.80 g/mol
LogP2.96
Rot. Bonds7

About 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol

2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol (PubChem CID 62014085) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol.

Molecular Properties

Compound Name2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol
PubChem CID62014085
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC Name2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol
SMILESOCCN(CCOc1ccccc1Cl)C1CCCC1
InChIInChI=1S/C15H22ClNO2/c16-14-7-3-4-8-15(14)19-12-10-17(9-11-18)13-5-1-2-6-13/h3-4,7-8,13,18H,1-2,5-6,9-12H2
InChIKeyMCMFXYMSKZIXQR-UHFFFAOYSA-N
XLogP2.96
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclohexyl-[2-(2,4-dichlorophenoxy)ethyl]amino]ethanol
CID 63470319
2-[cyclobutyl-[2-(2,4-dichlorophenoxy)ethyl]amino]ethanol
CID 102676706
2-[cyclopropyl-[2-(2,6-dichlorophenoxy)ethyl]amino]ethanol
CID 60774461
2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol
CID 60911429
2-[2-[cyclopropyl(2-hydroxyethyl)amino]ethoxy]benzoic acid
CID 54994962
3-(2-chlorophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
CID 43576626
2-[3-[2-(aminomethyl)phenoxy]propyl-cyclobutylamino]ethanol
CID 102860726
2-[cyclopentyl-[2-(4-ethoxyphenoxy)ethyl]amino]ethanol
CID 62016041
2-[2-(4-aminophenoxy)ethyl-cyclopentylamino]ethanol
CID 54993366
N-[2-(2-chlorophenoxy)ethyl]-N-propylazetidin-3-amine
CID 66214909
2-[2-(2-chlorophenoxy)ethyl-propan-2-ylamino]ethanol
CID 60691858
N-[2-(2-chlorophenoxy)ethyl]-N-propylpyrrolidin-3-amine;hydrochloride
CID 119921660

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol?
The IUPAC name of 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol (CID 62014085) is 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol.
What is the SMILES notation for 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol?
The canonical SMILES for 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol is OCCN(CCOc1ccccc1Cl)C1CCCC1.
What is the InChIKey of 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol?
The InChIKey is MCMFXYMSKZIXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2/c16-14-7-3-4-8-15(14)19-12-10-17(9-11-18)13-5-1-2-6-13/h3-4,7-8,13,18H,1-2,5-6,9-12H2.
What are the key properties of 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol?
2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol has a molecular weight of 283.80 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol is sourced from PubChem (CID 62014085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).