4-(2-methylpyrrolidin-2-yl)phenol

C11H15NO — CID 82599572

IUPAC4-(2-methylpyrrolidin-2-yl)phenol
SMILESCC1(c2ccc(O)cc2)CCCN1
InChIInChI=1S/C11H15NO/c1-11(7-2-8-12-11)9-3-5-10(13)6-4-9/h3-6,12-13H,2,7-8H2,1H3
InChIKeyMWRMCYPWVRBJDV-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.99
Rot. Bonds1

About 4-(2-methylpyrrolidin-2-yl)phenol

4-(2-methylpyrrolidin-2-yl)phenol (PubChem CID 82599572) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 4-(2-methylpyrrolidin-2-yl)phenol.

Molecular Properties

Compound Name4-(2-methylpyrrolidin-2-yl)phenol
PubChem CID82599572
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name4-(2-methylpyrrolidin-2-yl)phenol
SMILESCC1(c2ccc(O)cc2)CCCN1
InChIInChI=1S/C11H15NO/c1-11(7-2-8-12-11)9-3-5-10(13)6-4-9/h3-6,12-13H,2,7-8H2,1H3
InChIKeyMWRMCYPWVRBJDV-UHFFFAOYSA-N
XLogP1.99
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-methylazepan-2-yl)phenol
CID 115059442
2-(4-ethoxyphenyl)-2-methylpyrrolidine
CID 66467822
4-(2-propan-2-ylpyrrolidin-2-yl)phenol
CID 115058626
2-methyl-2-phenylpiperidine;hydrochloride
CID 115027708
2-methyl-2-[4-(2-methylprop-2-enoxy)phenyl]pyrrolidine
CID 117335007
2-[4-(2,2-difluoropropyl)phenyl]-2-methylpyrrolidine
CID 117351181
2-[4-(difluoromethylsulfanyl)phenyl]-2-methylpyrrolidine
CID 117360520
3-bromo-4-(2-methylpyrrolidin-2-yl)phenol
CID 82623381
2-[4-(2,2-difluoroethyl)phenyl]-2-methylpyrrolidine
CID 117323688
2-methyl-2-[4-(2-methylbutan-2-yl)phenyl]pyrrolidine
CID 117335142
2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine
CID 117366157
2-(4-chloro-3-methylphenyl)-2-methylpyrrolidine
CID 117299725

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpyrrolidin-2-yl)phenol?
The IUPAC name of 4-(2-methylpyrrolidin-2-yl)phenol (CID 82599572) is 4-(2-methylpyrrolidin-2-yl)phenol.
What is the SMILES notation for 4-(2-methylpyrrolidin-2-yl)phenol?
The canonical SMILES for 4-(2-methylpyrrolidin-2-yl)phenol is CC1(c2ccc(O)cc2)CCCN1.
What is the InChIKey of 4-(2-methylpyrrolidin-2-yl)phenol?
The InChIKey is MWRMCYPWVRBJDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-11(7-2-8-12-11)9-3-5-10(13)6-4-9/h3-6,12-13H,2,7-8H2,1H3.
What are the key properties of 4-(2-methylpyrrolidin-2-yl)phenol?
4-(2-methylpyrrolidin-2-yl)phenol has a molecular weight of 177.25 g/mol, XLogP of 1.99, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpyrrolidin-2-yl)phenol is sourced from PubChem (CID 82599572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).