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

C13H19NO2 — CID 61229092

IUPAC2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol
SMILESCN(C)c1cccc(OC2CCCC2O)c1
InChIInChI=1S/C13H19NO2/c1-14(2)10-5-3-6-11(9-10)16-13-8-4-7-12(13)15/h3,5-6,9,12-13,15H,4,7-8H2,1-2H3
InChIKeyQKFLHODGQJTEGU-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.04
Rot. Bonds3

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

2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol (PubChem CID 61229092) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol
PubChem CID61229092
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol
SMILESCN(C)c1cccc(OC2CCCC2O)c1
InChIInChI=1S/C13H19NO2/c1-14(2)10-5-3-6-11(9-10)16-13-8-4-7-12(13)15/h3,5-6,9,12-13,15H,4,7-8H2,1-2H3
InChIKeyQKFLHODGQJTEGU-UHFFFAOYSA-N
XLogP2.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol?
The IUPAC name of 2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol (CID 61229092) is 2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol.
What is the SMILES notation for 2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol?
The canonical SMILES for 2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol is CN(C)c1cccc(OC2CCCC2O)c1.
What is the InChIKey of 2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol?
The InChIKey is QKFLHODGQJTEGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-14(2)10-5-3-6-11(9-10)16-13-8-4-7-12(13)15/h3,5-6,9,12-13,15H,4,7-8H2,1-2H3.
What are the key properties of 2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol?
2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol has a molecular weight of 221.30 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)phenoxy]cyclopentan-1-ol is sourced from PubChem (CID 61229092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).