5-methoxy-2-pyrrolidin-1-ylphenol

C11H15NO2 — CID 168512796

IUPAC5-methoxy-2-pyrrolidin-1-ylphenol
SMILESCOc1ccc(N2CCCC2)c(O)c1
InChIInChI=1S/C11H15NO2/c1-14-9-4-5-10(11(13)8-9)12-6-2-3-7-12/h4-5,8,13H,2-3,6-7H2,1H3
InChIKeyRFTGSRDBVNUSPZ-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.00
Rot. Bonds2

About 5-methoxy-2-pyrrolidin-1-ylphenol

5-methoxy-2-pyrrolidin-1-ylphenol (PubChem CID 168512796) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-methoxy-2-pyrrolidin-1-ylphenol.

Molecular Properties

Compound Name5-methoxy-2-pyrrolidin-1-ylphenol
PubChem CID168512796
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name5-methoxy-2-pyrrolidin-1-ylphenol
SMILESCOc1ccc(N2CCCC2)c(O)c1
InChIInChI=1S/C11H15NO2/c1-14-9-4-5-10(11(13)8-9)12-6-2-3-7-12/h4-5,8,13H,2-3,6-7H2,1H3
InChIKeyRFTGSRDBVNUSPZ-UHFFFAOYSA-N
XLogP2.00
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

1-(5-methoxy-2-pyrrolidin-1-ylphenyl)ethanol
CID 117316095
5-methoxy-2-piperidin-1-ylbenzoic acid
CID 70528238
1-(5-methoxy-2-piperidin-1-ylphenyl)ethanone
CID 117338408
2-(5-methoxy-2-piperidin-1-ylphenyl)ethanol
CID 117343468
1-(5-methoxy-2-pyrrolidin-1-ylphenyl)-2-(methylamino)ethanone
CID 117374092
methyl 2-hydroxy-2-(5-methoxy-2-piperidin-1-ylphenyl)acetate
CID 117447811
6-methoxy-1-piperidin-1-ylnaphthalen-2-ol
CID 141446934
1-(5-methoxy-2-piperidin-1-ylphenyl)propan-2-amine
CID 117374676
2-(5-methoxy-2-pyrrolidin-1-ylphenyl)propan-1-amine
CID 117341151
5-methoxy-2-(1-pyrrolidin-1-ylethyl)phenol
CID 82974711
2-[1-(5-methoxy-2-piperidin-1-ylphenyl)cyclopropyl]acetic acid
CID 117467602
2-hydroxy-5-methoxy-N-(2-piperidin-1-ylphenyl)benzamide
CID 112809580

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-pyrrolidin-1-ylphenol?
The IUPAC name of 5-methoxy-2-pyrrolidin-1-ylphenol (CID 168512796) is 5-methoxy-2-pyrrolidin-1-ylphenol.
What is the SMILES notation for 5-methoxy-2-pyrrolidin-1-ylphenol?
The canonical SMILES for 5-methoxy-2-pyrrolidin-1-ylphenol is COc1ccc(N2CCCC2)c(O)c1.
What is the InChIKey of 5-methoxy-2-pyrrolidin-1-ylphenol?
The InChIKey is RFTGSRDBVNUSPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-14-9-4-5-10(11(13)8-9)12-6-2-3-7-12/h4-5,8,13H,2-3,6-7H2,1H3.
What are the key properties of 5-methoxy-2-pyrrolidin-1-ylphenol?
5-methoxy-2-pyrrolidin-1-ylphenol has a molecular weight of 193.25 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-pyrrolidin-1-ylphenol is sourced from PubChem (CID 168512796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).