2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol

C9H19NO2 — CID 89249083

IUPAC2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol
SMILESCN(CCO)C1CCCC1CO
InChIInChI=1S/C9H19NO2/c1-10(5-6-11)9-4-2-3-8(9)7-12/h8-9,11-12H,2-7H2,1H3
InChIKeyDRCIMVQCRWLUFE-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.07
Rot. Bonds4

About 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol

2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol (PubChem CID 89249083) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol.

Molecular Properties

Compound Name2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol
PubChem CID89249083
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol
SMILESCN(CCO)C1CCCC1CO
InChIInChI=1S/C9H19NO2/c1-10(5-6-11)9-4-2-3-8(9)7-12/h8-9,11-12H,2-7H2,1H3
InChIKeyDRCIMVQCRWLUFE-UHFFFAOYSA-N
XLogP0.07
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol?
The IUPAC name of 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol (CID 89249083) is 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol.
What is the SMILES notation for 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol?
The canonical SMILES for 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol is CN(CCO)C1CCCC1CO.
What is the InChIKey of 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol?
The InChIKey is DRCIMVQCRWLUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-10(5-6-11)9-4-2-3-8(9)7-12/h8-9,11-12H,2-7H2,1H3.
What are the key properties of 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol?
2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol has a molecular weight of 173.26 g/mol, XLogP of 0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(hydroxymethyl)cyclopentyl]-methylamino]ethanol is sourced from PubChem (CID 89249083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).