[2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol

C17H34N2O — CID 79570944

IUPAC[2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol
SMILESCCNC1(CO)CCCC1CCN1CC(C)CC(C)C1
InChIInChI=1S/C17H34N2O/c1-4-18-17(13-20)8-5-6-16(17)7-9-19-11-14(2)10-15(3)12-19/h14-16,18,20H,4-13H2,1-3H3
InChIKeyXUOPRORPKNYKOE-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.50
Rot. Bonds6

About [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol

[2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol (PubChem CID 79570944) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol
PubChem CID79570944
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name[2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol
SMILESCCNC1(CO)CCCC1CCN1CC(C)CC(C)C1
InChIInChI=1S/C17H34N2O/c1-4-18-17(13-20)8-5-6-16(17)7-9-19-11-14(2)10-15(3)12-19/h14-16,18,20H,4-13H2,1-3H3
InChIKeyXUOPRORPKNYKOE-UHFFFAOYSA-N
XLogP2.50
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571011
[1-(ethylamino)-2-[2-(2-ethylmorpholin-4-yl)ethyl]cyclopentyl]methanol
CID 79571378
[2-[2-(3-ethoxypiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol
CID 79568045
[2-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol
CID 79570956
[2-[2-(3-methylpyrrolidin-1-yl)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571310
[1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol
CID 79571967
[1-(ethylamino)-2-[2-(3-methylmorpholin-4-yl)ethyl]cyclopentyl]methanol
CID 79571730
[2-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79567766
[1-(ethylamino)-2-[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)ethyl]cyclopentyl]methanol
CID 102887341
[2-[2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 104968989
[2-[2-(3,4-dimethoxypyrrolidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 103540797
[2-[2-(4-methylpiperidin-1-yl)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571574

Frequently Asked Questions

What is the IUPAC name of [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol?
The IUPAC name of [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol (CID 79570944) is [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol?
The canonical SMILES for [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol is CCNC1(CO)CCCC1CCN1CC(C)CC(C)C1.
What is the InChIKey of [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol?
The InChIKey is XUOPRORPKNYKOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-4-18-17(13-20)8-5-6-16(17)7-9-19-11-14(2)10-15(3)12-19/h14-16,18,20H,4-13H2,1-3H3.
What are the key properties of [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol?
[2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol has a molecular weight of 282.47 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol is sourced from PubChem (CID 79570944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).