2-methyl-4-pyrrolidin-2-ylphenol

C11H15NO — CID 55283669

IUPAC2-methyl-4-pyrrolidin-2-ylphenol
SMILESCc1cc(C2CCCN2)ccc1O
InChIInChI=1S/C11H15NO/c1-8-7-9(4-5-11(8)13)10-3-2-6-12-10/h4-5,7,10,12-13H,2-3,6H2,1H3
InChIKeyNUGNQNGTFZQSEJ-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.13
Rot. Bonds1

About 2-methyl-4-pyrrolidin-2-ylphenol

2-methyl-4-pyrrolidin-2-ylphenol (PubChem CID 55283669) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-methyl-4-pyrrolidin-2-ylphenol.

Molecular Properties

Compound Name2-methyl-4-pyrrolidin-2-ylphenol
PubChem CID55283669
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name2-methyl-4-pyrrolidin-2-ylphenol
SMILESCc1cc(C2CCCN2)ccc1O
InChIInChI=1S/C11H15NO/c1-8-7-9(4-5-11(8)13)10-3-2-6-12-10/h4-5,7,10,12-13H,2-3,6H2,1H3
InChIKeyNUGNQNGTFZQSEJ-UHFFFAOYSA-N
XLogP2.13
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 ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-4-[(2R)-piperidin-2-yl]phenol
CID 131198389
4-[(2S)-pyrrolidin-2-yl]benzene-1,2-diol
CID 66518287
2-bromo-4-[(2R)-pyrrolidin-2-yl]phenol
CID 66519672
2-amino-4-[(2R)-pyrrolidin-2-yl]phenol
CID 66518284
(2S)-2-(4-chloro-3-methylphenyl)pyrrolidine
CID 55253037
2-bromo-4-[(2R)-pyrrolidin-2-yl]phenol;hydrochloride
CID 171195910
2-methyl-4-[(2S)-pyrrolidin-2-yl]benzonitrile
CID 66518349
2-hydroxy-5-pyrrolidin-2-ylbenzonitrile
CID 77131425
2-iodo-4-[(2S)-piperidin-2-yl]phenol
CID 130646263
2-methyl-4-piperidin-3-ylphenol
CID 84663479
O-methyl 2-methyl-4-pyrrolidin-2-ylbenzenecarbothioate
CID 174459027
(2R)-2-(4-methylphenyl)pyrrolidine
CID 7047871

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-pyrrolidin-2-ylphenol?
The IUPAC name of 2-methyl-4-pyrrolidin-2-ylphenol (CID 55283669) is 2-methyl-4-pyrrolidin-2-ylphenol.
What is the SMILES notation for 2-methyl-4-pyrrolidin-2-ylphenol?
The canonical SMILES for 2-methyl-4-pyrrolidin-2-ylphenol is Cc1cc(C2CCCN2)ccc1O.
What is the InChIKey of 2-methyl-4-pyrrolidin-2-ylphenol?
The InChIKey is NUGNQNGTFZQSEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-8-7-9(4-5-11(8)13)10-3-2-6-12-10/h4-5,7,10,12-13H,2-3,6H2,1H3.
What are the key properties of 2-methyl-4-pyrrolidin-2-ylphenol?
2-methyl-4-pyrrolidin-2-ylphenol has a molecular weight of 177.25 g/mol, XLogP of 2.13, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-pyrrolidin-2-ylphenol is sourced from PubChem (CID 55283669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).