[1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol

C15H23NO2 — CID 79645788

IUPAC[1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol
SMILESCCNC1(CO)CCC(Oc2cccc(C)c2)C1
InChIInChI=1S/C15H23NO2/c1-3-16-15(11-17)8-7-14(10-15)18-13-6-4-5-12(2)9-13/h4-6,9,14,16-17H,3,7-8,10-11H2,1-2H3
InChIKeyTXYIBEBRMJVVDK-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.27
Rot. Bonds5

About [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol

[1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol (PubChem CID 79645788) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol
PubChem CID79645788
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name[1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol
SMILESCCNC1(CO)CCC(Oc2cccc(C)c2)C1
InChIInChI=1S/C15H23NO2/c1-3-16-15(11-17)8-7-14(10-15)18-13-6-4-5-12(2)9-13/h4-6,9,14,16-17H,3,7-8,10-11H2,1-2H3
InChIKeyTXYIBEBRMJVVDK-UHFFFAOYSA-N
XLogP2.27
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(methylamino)-3-(3-methylphenoxy)cyclopentyl]methanol
CID 79645520
[1-(ethylamino)-3-(3-propan-2-ylphenoxy)cyclopentyl]methanol
CID 79645784
[3-phenoxy-1-(propylamino)cyclopentyl]methanol
CID 79645048
[3-[3-(hydroxymethyl)-3-(methylamino)cyclopentyl]oxyphenyl]methanol
CID 79646018
[1-(cyclopropylamino)-3-phenoxycyclopentyl]methanol
CID 79645287
[3-(3-fluoro-4-methylphenoxy)-1-(propylamino)cyclopentyl]methanol
CID 107171546
[1-(propylamino)-3-(4-propylphenoxy)cyclopentyl]methanol
CID 79645486
[3-(2-butan-2-ylphenoxy)-1-(ethylamino)cyclopentyl]methanol
CID 79647774
3-(3-ethoxyphenoxy)-1-(ethylamino)cyclopentane-1-carboxylic acid
CID 79648163
[3-phenoxy-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79645524
[1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol
CID 79646293
[3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol
CID 79646252

Frequently Asked Questions

What is the IUPAC name of [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol?
The IUPAC name of [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol (CID 79645788) is [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol.
What is the SMILES notation for [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol?
The canonical SMILES for [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol is CCNC1(CO)CCC(Oc2cccc(C)c2)C1.
What is the InChIKey of [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol?
The InChIKey is TXYIBEBRMJVVDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-16-15(11-17)8-7-14(10-15)18-13-6-4-5-12(2)9-13/h4-6,9,14,16-17H,3,7-8,10-11H2,1-2H3.
What are the key properties of [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol?
[1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol has a molecular weight of 249.35 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethylamino)-3-(3-methylphenoxy)cyclopentyl]methanol is sourced from PubChem (CID 79645788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).