[1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol

C13H23N3O — CID 79571967

IUPAC[1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol
SMILESCCNC1(CO)CCCC1CCn1ccnc1
InChIInChI=1S/C13H23N3O/c1-2-15-13(10-17)6-3-4-12(13)5-8-16-9-7-14-11-16/h7,9,11-12,15,17H,2-6,8,10H2,1H3
InChIKeyXKKGVYKPAILAAS-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.41
Rot. Bonds6

About [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol

[1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol (PubChem CID 79571967) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol
PubChem CID79571967
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name[1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol
SMILESCCNC1(CO)CCCC1CCn1ccnc1
InChIInChI=1S/C13H23N3O/c1-2-15-13(10-17)6-3-4-12(13)5-8-16-9-7-14-11-16/h7,9,11-12,15,17H,2-6,8,10H2,1H3
InChIKeyXKKGVYKPAILAAS-UHFFFAOYSA-N
XLogP1.41
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[2-(3-ethoxypiperidin-1-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol
CID 79568045
[2-[2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 104968989
[2-[2-(2,5-dimethylmorpholin-4-yl)ethyl]-1-(ethylamino)cyclopentyl]methanol
CID 79570956
[1-(ethylamino)-2-[2-(2-methoxyethoxy)ethyl]cyclopentyl]methanol
CID 79581609
[1-(ethylamino)-2-(2-pyridin-2-ylsulfanylethyl)cyclopentyl]methanol
CID 79581411
[2-(2-cyclohexyloxyethyl)-1-(ethylamino)cyclopentyl]methanol
CID 79581004
[2-[2-(4,4-dimethylcyclohexyl)oxyethyl]-1-(ethylamino)cyclopentyl]methanol
CID 114342766
[2-[2-[3,3-dimethylbutan-2-yl(methyl)amino]ethyl]-1-(ethylamino)cyclopentyl]methanol
CID 79571170
2-imidazol-1-ylethanol
CID 159023310
[1-(methylamino)-2-[2-(5-methylpyrazol-1-yl)ethyl]cyclopentyl]methanol
CID 79581366
1-cyclopentyl-3-ethyl-2-(2-imidazol-1-ylethyl)guanidine
CID 110991931
1-cyclopentyl-3-ethyl-2-(2-imidazol-1-ylethyl)guanidine;hydroiodide
CID 110991930

Frequently Asked Questions

What is the IUPAC name of [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol?
The IUPAC name of [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol (CID 79571967) is [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol.
What is the SMILES notation for [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol?
The canonical SMILES for [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol is CCNC1(CO)CCCC1CCn1ccnc1.
What is the InChIKey of [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol?
The InChIKey is XKKGVYKPAILAAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-2-15-13(10-17)6-3-4-12(13)5-8-16-9-7-14-11-16/h7,9,11-12,15,17H,2-6,8,10H2,1H3.
What are the key properties of [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol?
[1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol has a molecular weight of 237.35 g/mol, XLogP of 1.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethylamino)-2-(2-imidazol-1-ylethyl)cyclopentyl]methanol is sourced from PubChem (CID 79571967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).