2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol

C13H25NO2 — CID 115890660

IUPAC2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol
SMILESCCC1CCCC1NCC(O)C1CCOC1
InChIInChI=1S/C13H25NO2/c1-2-10-4-3-5-12(10)14-8-13(15)11-6-7-16-9-11/h10-15H,2-9H2,1H3
InChIKeyVGEPKOOSOIIPOM-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.55
Rot. Bonds5

About 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol

2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol (PubChem CID 115890660) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol.

Molecular Properties

Compound Name2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol
PubChem CID115890660
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol
SMILESCCC1CCCC1NCC(O)C1CCOC1
InChIInChI=1S/C13H25NO2/c1-2-10-4-3-5-12(10)14-8-13(15)11-6-7-16-9-11/h10-15H,2-9H2,1H3
InChIKeyVGEPKOOSOIIPOM-UHFFFAOYSA-N
XLogP1.55
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-2-[(2-ethylcyclopentyl)amino]ethanol
CID 115890580
2-(2-ethylcyclohexyl)oxy-1-(oxolan-3-yl)ethanol
CID 104753532
1-[(2-ethylcyclopentyl)amino]pentan-2-ol
CID 115719434
2-N,2-N-diethyl-1-N-(2-ethylcyclopentyl)propane-1,2-diamine
CID 115708738
2-(4-methylpentan-2-ylamino)-1-(oxolan-3-yl)ethanol
CID 115890653
2-(2-methylpentylamino)-1-(oxolan-3-yl)ethanol
CID 115907653
2-(hexan-2-ylamino)-1-(oxolan-3-yl)ethanol
CID 115890644
1-(cyclopropylmethoxy)-3-[(2-ethylcyclohexyl)amino]propan-2-ol
CID 54955680
2-[(2-ethylcyclopentyl)amino]-1-phenylethanol
CID 115706038
N-(2-ethylcyclohexyl)oxan-4-amine
CID 43709257
2-(2-methoxyethylamino)-1-(oxolan-3-yl)ethanol
CID 62773174
4-[[(2-ethylcyclohexyl)amino]methyl]oxan-4-ol
CID 81130333

Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol?
The IUPAC name of 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol (CID 115890660) is 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol.
What is the SMILES notation for 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol?
The canonical SMILES for 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol is CCC1CCCC1NCC(O)C1CCOC1.
What is the InChIKey of 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol?
The InChIKey is VGEPKOOSOIIPOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-2-10-4-3-5-12(10)14-8-13(15)11-6-7-16-9-11/h10-15H,2-9H2,1H3.
What are the key properties of 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol?
2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol has a molecular weight of 227.35 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethylcyclopentyl)amino]-1-(oxolan-3-yl)ethanol is sourced from PubChem (CID 115890660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).