2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol

C15H22ClNO2 — CID 60911429

IUPAC2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol
SMILESOCCN(CCOc1ccc(Cl)cc1)C1CCCC1
InChIInChI=1S/C15H22ClNO2/c16-13-5-7-15(8-6-13)19-12-10-17(9-11-18)14-3-1-2-4-14/h5-8,14,18H,1-4,9-12H2
InChIKeyGPASCFUGYTXTJF-UHFFFAOYSA-N
MW283.80 g/mol
LogP2.96
Rot. Bonds7

About 2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol

2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol (PubChem CID 60911429) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is 2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol.

Molecular Properties

Compound Name2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol
PubChem CID60911429
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC Name2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol
SMILESOCCN(CCOc1ccc(Cl)cc1)C1CCCC1
InChIInChI=1S/C15H22ClNO2/c16-13-5-7-15(8-6-13)19-12-10-17(9-11-18)14-3-1-2-4-14/h5-8,14,18H,1-4,9-12H2
InChIKeyGPASCFUGYTXTJF-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-[cyclopentyl-[2-(4-ethoxyphenoxy)ethyl]amino]ethanol
CID 62016041
2-[2-(4-aminophenoxy)ethyl-cyclopentylamino]ethanol
CID 54993366
2-[cyclohexyl-[2-(2,4-dichlorophenoxy)ethyl]amino]ethanol
CID 63470319
2-[cyclobutyl-[2-(2,4-dichlorophenoxy)ethyl]amino]ethanol
CID 102676706
2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol
CID 62014085
2-[2-(4-chlorophenoxy)ethyl-cyclopropylamino]acetic acid
CID 54945677
3-[2-[4-(aminomethyl)phenoxy]ethyl-cyclobutylamino]propan-1-ol
CID 102860586
1-(4-chlorophenyl)-3-[cyclopentyl(2-hydroxyethyl)amino]propan-1-ol
CID 62629823
2-[cyclopropyl-[2-(2,6-dichlorophenoxy)ethyl]amino]ethanol
CID 60774461
3-[3-(4-aminophenoxy)propyl-cyclobutylamino]propan-1-ol
CID 102859994
N-[2-(4-bromophenoxy)ethyl]-N-(2-chloroethyl)cyclopropanamine
CID 55182790
2-[cyclohexyl-[3-(3-methylphenoxy)propyl]amino]ethanol
CID 60696695

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol?
The IUPAC name of 2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol (CID 60911429) is 2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol.
What is the SMILES notation for 2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol?
The canonical SMILES for 2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol is OCCN(CCOc1ccc(Cl)cc1)C1CCCC1.
What is the InChIKey of 2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol?
The InChIKey is GPASCFUGYTXTJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2/c16-13-5-7-15(8-6-13)19-12-10-17(9-11-18)14-3-1-2-4-14/h5-8,14,18H,1-4,9-12H2.
What are the key properties of 2-[2-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol?
2-[2-(4-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-(4-chlorophenoxy)ethyl-cyclopentylamino]ethanol is sourced from PubChem (CID 60911429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).