3-pyrrolidin-3-yloxyphenol

C10H13NO2 — CID 83482218

IUPAC3-pyrrolidin-3-yloxyphenol
SMILESOc1cccc(OC2CCNC2)c1
InChIInChI=1S/C10H13NO2/c12-8-2-1-3-9(6-8)13-10-4-5-11-7-10/h1-3,6,10-12H,4-5,7H2
InChIKeyOXQVHQKYRBHXIN-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.13
Rot. Bonds2

About 3-pyrrolidin-3-yloxyphenol

3-pyrrolidin-3-yloxyphenol (PubChem CID 83482218) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 3-pyrrolidin-3-yloxyphenol.

Molecular Properties

Compound Name3-pyrrolidin-3-yloxyphenol
PubChem CID83482218
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name3-pyrrolidin-3-yloxyphenol
SMILESOc1cccc(OC2CCNC2)c1
InChIInChI=1S/C10H13NO2/c12-8-2-1-3-9(6-8)13-10-4-5-11-7-10/h1-3,6,10-12H,4-5,7H2
InChIKeyOXQVHQKYRBHXIN-UHFFFAOYSA-N
XLogP1.13
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3R)-pyrrolidin-3-yl]oxyaniline
CID 74892056
(3R)-3-(3-methylphenoxy)pyrrolidine
CID 24795651
3-(3-methylphenoxy)pyrrolidine
CID 18337170
(3S)-3-(3-ethylphenoxy)pyrrolidine
CID 26192115
3-pyrrolidin-3-yloxybenzaldehyde
CID 87190134
3-[(3S)-pyrrolidin-3-yl]oxypyridine;hydrochloride
CID 70102226
(3S)-3-(4-fluorophenoxy)pyrrolidine
CID 26192125
(3S)-3-(3,5-dimethylphenoxy)pyrrolidine
CID 26192104
CID 59418392
CID 59418392
3-[3-(2-fluoropropan-2-yl)phenoxy]piperidine
CID 115042136
3-(3-hydroxycyclohexyl)oxyphenol
CID 117095404
3-piperidin-3-yloxybenzonitrile
CID 22309128

Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-3-yloxyphenol?
The IUPAC name of 3-pyrrolidin-3-yloxyphenol (CID 83482218) is 3-pyrrolidin-3-yloxyphenol.
What is the SMILES notation for 3-pyrrolidin-3-yloxyphenol?
The canonical SMILES for 3-pyrrolidin-3-yloxyphenol is Oc1cccc(OC2CCNC2)c1.
What is the InChIKey of 3-pyrrolidin-3-yloxyphenol?
The InChIKey is OXQVHQKYRBHXIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c12-8-2-1-3-9(6-8)13-10-4-5-11-7-10/h1-3,6,10-12H,4-5,7H2.
What are the key properties of 3-pyrrolidin-3-yloxyphenol?
3-pyrrolidin-3-yloxyphenol has a molecular weight of 179.22 g/mol, XLogP of 1.13, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-3-yloxyphenol is sourced from PubChem (CID 83482218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).