3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol

C9H19NO2 — CID 130125292

IUPAC3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol
SMILESCN(C)C(CO)C1CCC(O)C1
InChIInChI=1S/C9H19NO2/c1-10(2)9(6-11)7-3-4-8(12)5-7/h7-9,11-12H,3-6H2,1-2H3
InChIKeyKKJIJDLZQGABGC-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.07
Rot. Bonds3

About 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol

3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol (PubChem CID 130125292) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol
PubChem CID130125292
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol
SMILESCN(C)C(CO)C1CCC(O)C1
InChIInChI=1S/C9H19NO2/c1-10(2)9(6-11)7-3-4-8(12)5-7/h7-9,11-12H,3-6H2,1-2H3
InChIKeyKKJIJDLZQGABGC-UHFFFAOYSA-N
XLogP0.07
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
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 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol?
The IUPAC name of 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol (CID 130125292) is 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol?
The canonical SMILES for 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol is CN(C)C(CO)C1CCC(O)C1.
What is the InChIKey of 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol?
The InChIKey is KKJIJDLZQGABGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-10(2)9(6-11)7-3-4-8(12)5-7/h7-9,11-12H,3-6H2,1-2H3.
What are the key properties of 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol?
3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol has a molecular weight of 173.26 g/mol, XLogP of 0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(dimethylamino)-2-hydroxyethyl]cyclopentan-1-ol is sourced from PubChem (CID 130125292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).