(2-pyrrolidin-1-ylphenyl)methanol

C11H15NO — CID 13021765

IUPAC(2-pyrrolidin-1-ylphenyl)methanol
SMILESOCc1ccccc1N1CCCC1
InChIInChI=1S/C11H15NO/c13-9-10-5-1-2-6-11(10)12-7-3-4-8-12/h1-2,5-6,13H,3-4,7-9H2
InChIKeyQXIYEQQTAPJDBX-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.78
Rot. Bonds2

About (2-pyrrolidin-1-ylphenyl)methanol

(2-pyrrolidin-1-ylphenyl)methanol (PubChem CID 13021765) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is (2-pyrrolidin-1-ylphenyl)methanol.

Molecular Properties

Compound Name(2-pyrrolidin-1-ylphenyl)methanol
PubChem CID13021765
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name(2-pyrrolidin-1-ylphenyl)methanol
SMILESOCc1ccccc1N1CCCC1
InChIInChI=1S/C11H15NO/c13-9-10-5-1-2-6-11(10)12-7-3-4-8-12/h1-2,5-6,13H,3-4,7-9H2
InChIKeyQXIYEQQTAPJDBX-UHFFFAOYSA-N
XLogP1.78
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-pyrrolidin-1-ylphenyl)methanol?
The IUPAC name of (2-pyrrolidin-1-ylphenyl)methanol (CID 13021765) is (2-pyrrolidin-1-ylphenyl)methanol.
What is the SMILES notation for (2-pyrrolidin-1-ylphenyl)methanol?
The canonical SMILES for (2-pyrrolidin-1-ylphenyl)methanol is OCc1ccccc1N1CCCC1.
What is the InChIKey of (2-pyrrolidin-1-ylphenyl)methanol?
The InChIKey is QXIYEQQTAPJDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c13-9-10-5-1-2-6-11(10)12-7-3-4-8-12/h1-2,5-6,13H,3-4,7-9H2.
What are the key properties of (2-pyrrolidin-1-ylphenyl)methanol?
(2-pyrrolidin-1-ylphenyl)methanol has a molecular weight of 177.25 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-pyrrolidin-1-ylphenyl)methanol is sourced from PubChem (CID 13021765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).